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 9 results

Search term: VLXCELORZFJXKB (Found by InChIKey (skeleton match))
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
3388429

0 of 2 defined stereocentres - 0/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)
C16H17NO4287.31048443100
5390754

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/t13-,14+/m1/s1
C16H17NO4287.31054400
5390756

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/t13-,14+/m0/s1
C16H17NO4287.31052100
5390752

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/t13-,14-/m0/s1
C16H17NO4287.31052100
5390758

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/t13-,14-/m1/s1
C16H17NO4287.31052100
5390753

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/p-1/t13-,14+/m1/s1
C16H16NO4286.30311100
5390751

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/p-1/t13-,14-/m0/s1
C16H16NO4286.30311100
5390757

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/p-1/t13-,14-/m1/s1
C16H16NO4286.30311100
5390755

Charge

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C16H17NO4/c1-10(18)11-6-8-12(9-7-11)17-15(19)13-4-2-3-5-14(13)16(20)21/h2-3,6-9,13-14H,4-5H2,1H3,(H,17,19)(H,20,21)/p-1/t13-,14+/m0/s1
C16H16NO4286.30311100

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