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 5 results

Search term: KWTCFVVUAIROBC (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
2690718

0 of 1 defined stereocentres - 0/1 defined
InChI=1/C17H12F3NO4S/c18-17(19,20)10-3-1-9(2-4-10)15-21(14(23)8-26-15)11-5-6-12(16(24)25)13(22)7-11/h1-7,15,22H,8H2,(H,24,25)
C17H12F3NO4S383.34168967400
1070849

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H12F3NO4S/c18-17(19,20)10-3-1-9(2-4-10)15-21(14(23)8-26-15)11-5-6-12(16(24)25)13(22)7-11/h1-7,15,22H,8H2,(H,24,25)/t15-/m0/s1
C17H12F3NO4S383.34172100
1070850

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H12F3NO4S/c18-17(19,20)10-3-1-9(2-4-10)15-21(14(23)8-26-15)11-5-6-12(16(24)25)13(22)7-11/h1-7,15,22H,8H2,(H,24,25)/t15-/m1/s1
C17H12F3NO4S383.34172100
6070337

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H12F3NO4S/c18-17(19,20)10-3-1-9(2-4-10)15-21(14(23)8-26-15)11-5-6-12(16(24)25)13(22)7-11/h1-7,15,22H,8H2,(H,24,25)/p-1/t15-/m1/s1
C17H11F3NO4S382.33431100
6070399

Charge

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C17H12F3NO4S/c18-17(19,20)10-3-1-9(2-4-10)15-21(14(23)8-26-15)11-5-6-12(16(24)25)13(22)7-11/h1-7,15,22H,8H2,(H,24,25)/p-1/t15-/m0/s1
C17H11F3NO4S382.33431100

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