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

Systemtic Name: 2-(8-chloranyl-11-oxidanylidene-6H-benzo[c][1]benzothiepin-2-yl)ethanoic acid Openeye Name: 2-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid CAS Name: 2-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid IUPAC Name: 2-(8-chloro-11-oxo-6H-benzo[c][1]benzothiepin-2-yl)acetic acid Traditional Name: 2-(8-chloro-11-keto-6H-benzo[c][1]benzothiepin-2-yl)acetic acid Formula: C16H11ClO3S MolecularWeight: 318.77474

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)Cl)C(=O)C3=C(S1)C=CC(=C3)CC(=O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)Cl)C(=O)C3=C(S1)C=CC(=C3)CC(=O)O

InChI

InChI=1S/C16H11ClO3S/c17-11-2-3-12-10(7-11)8-21-14-4-1-9(6-15(18)19)5-13(14)16(12)20/h1-5,7H,6,8H2,(H,18,19)