2-(6-oxidanylidene-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)ethanoic acid

Systemtic Name: 2-(6-oxidanylidene-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)ethanoic acid Openeye Name: 2-(6-oxo-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)acetic acid CAS Name: 2-(6-oxo-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)acetic acid IUPAC Name: 2-(6-oxo-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)acetic acid Traditional Name: 2-(6-keto-5H-[1]benzothiepino[2,3-b]pyridin-8-yl)acetic acid Formula: C15H11NO3S MolecularWeight: 285.31774

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(N=CC=C2)SC3=C(C1=O)C=C(C=C3)CC(=O)O

Isomeric SMILES

C1C2=C(N=CC=C2)SC3=C(C1=O)C=C(C=C3)CC(=O)O

InChI

InChI=1S/C15H11NO3S/c17-12-8-10-2-1-5-16-15(10)20-13-4-3-9(6-11(12)13)7-14(18)19/h1-6H,7-8H2,(H,18,19)