2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)ethanoic acid

Systemtic Name: 2-(6-oxidanylidenepyrido[2,3-b][1,4]benzothiazepin-5-yl)ethanoic acid Openeye Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetic acid CAS Name: 2-(6-oxo-5-pyrido[2,3-b][1,4]benzothiazepinyl)acetic acid IUPAC Name: 2-(6-oxopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetic acid Traditional Name: 2-(6-ketopyrido[2,3-b][1,4]benzothiazepin-5-yl)acetic acid Formula: C14H10N2O3S MolecularWeight: 286.3058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C3=C(S2)N=CC=C3)CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C3=C(S2)N=CC=C3)CC(=O)O

InChI

InChI=1S/C14H10N2O3S/c17-12(18)8-16-10-5-3-7-15-13(10)20-11-6-2-1-4-9(11)14(16)19/h1-7H,8H2,(H,17,18)