2-(6-benzamido-5-oxidanylidene-1,4-thiazepan-4-yl)ethanoic acid

Systemtic Name: 2-(6-benzamido-5-oxidanylidene-1,4-thiazepan-4-yl)ethanoic acid Openeye Name: 2-(6-benzamido-5-oxo-1,4-thiazepan-4-yl)acetic acid CAS Name: 2-(6-benzamido-5-oxo-1,4-thiazepan-4-yl)acetic acid IUPAC Name: 2-(6-benzamido-5-oxo-1,4-thiazepan-4-yl)acetic acid Traditional Name: 2-(6-benzamido-5-keto-1,4-thiazepan-4-yl)acetic acid Formula: C14H16N2O4S MolecularWeight: 308.35284

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC(C(=O)N1CC(=O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

C1CSCC(C(=O)N1CC(=O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H16N2O4S/c17-12(18)8-16-6-7-21-9-11(14(16)20)15-13(19)10-4-2-1-3-5-10/h1-5,11H,6-9H2,(H,15,19)(H,17,18)