Matches any text strings used to describe a molecule.
Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 18 results

Search term: REFMTLIXGKZVDF (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
279498

0 of 5 defined stereocentres - 0/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)
C12H15NO4237.2518362600
1482883

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8-,9+/m0/s1
C12H15NO4237.25187600
22845729

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5?,6-,7+,8+,9-
C12H15NO4237.25187500
26495956

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5?,6-,7+,8?,9?
C12H15NO4237.25187600
10140077

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8-,9+/m1/s1
C12H15NO4237.25183200
10140082

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8+,9-/m1/s1
C12H15NO4237.25183200
5371715

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8-,9-/m0/s1
C12H15NO4237.25182100
25055104

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6?,7?,8?,9?/m0/s1
C12H15NO4237.25182200
1272002

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8+,9-/m0/s1
C12H15NO4237.25182100
10054564

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5-,6-,7+,8+,9+/m1/s1
C12H15NO4237.25182100
1482882

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6+,7+,8-,9+/m1/s1
C12H14NO4236.24441100
1272001

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6-,7-,8-,9+/m1/s1
C12H14NO4236.24441100
4607808

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6+,7+,8-,9+/m0/s1
C12H14NO4236.24441100
4621019

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6-,7-,8-,9+/m0/s1
C12H14NO4236.24441100
5371714

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6-,7-,8-,9-/m0/s1
C12H14NO4236.24441100
30792693

Charge

1 of 5 defined stereocentres - 1/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6?,7?,8?,9?/m0/s1
C12H14NO4236.24441100
10054563

Charge

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/p-1/t5-,6+,7+,8+,9+/m1/s1
C12H14NO4236.24441100
17476397

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C12H15NO4/c1-5(12(16)17)13-10(14)8-6-2-3-7(4-6)9(8)11(13)15/h5-9H,2-4H2,1H3,(H,16,17)/t5?,6-,7-,8-,9+/m1/s1
C12H15NO4237.25181100

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