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

Systemtic Name: 2-(11-oxidanylidene-6H-benzo[c][1]benzothiepin-2-yl)ethanoic acid Openeye Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid CAS Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid IUPAC Name: 2-(11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid Traditional Name: 2-(11-keto-6H-benzo[c][1]benzothiepin-2-yl)acetic acid Formula: C16H12O3S MolecularWeight: 284.32968

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2C(=O)C3=C(S1)C=CC(=C3)CC(=O)O

Isomeric SMILES

C1C2=CC=CC=C2C(=O)C3=C(S1)C=CC(=C3)CC(=O)O

InChI

InChI=1S/C16H12O3S/c17-15(18)8-10-5-6-14-13(7-10)16(19)12-4-2-1-3-11(12)9-20-14/h1-7H,8-9H2,(H,17,18)