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2-(8-methyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-2-yl)ethanoic acid

2-(8-methyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-2-yl)ethanoic acid

Systemtic Name:2-(8-methyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-2-yl)ethanoic acid
Openeye Name:2-(8-methyl-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid
CAS Name:2-(8-methyl-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid
IUPAC Name:2-(8-methyl-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid
Traditional Name:2-(11-keto-8-methyl-6H-benzo[c][1]benzothiepin-2-yl)acetic acid
Formula: C17H14O3S
MolecularWeight: 298.35626
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C3=C(C=CC(=C3)CC(=O)O)SC2


Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C3=C(C=CC(=C3)CC(=O)O)SC2


InChI

InChI=1S/C17H14O3S/c1-10-2-4-13-12(6-10)9-21-15-5-3-11(8-16(18)19)7-14(15)17(13)20/h2-7H,8-9H2,1H3,(H,18,19)


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