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

Systemtic Name: 2-(2-naphthalen-1-yl-5-oxidanylidene-1,4-thiazepan-4-yl)ethanoic acid Openeye Name: 2-[2-(1-naphthyl)-5-oxo-1,4-thiazepan-4-yl]acetic acid CAS Name: 2-[2-(1-naphthalenyl)-5-oxo-1,4-thiazepan-4-yl]acetic acid IUPAC Name: 2-(2-naphthalen-1-yl-5-oxo-1,4-thiazepan-4-yl)acetic acid Traditional Name: 2-[5-keto-2-(1-naphthyl)-1,4-thiazepan-4-yl]acetic acid Formula: C17H17NO3S MolecularWeight: 315.38678

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(CN(C1=O)CC(=O)O)C2=CC=CC3=CC=CC=C32

Isomeric SMILES

C1CSC(CN(C1=O)CC(=O)O)C2=CC=CC3=CC=CC=C32

InChI

InChI=1S/C17H17NO3S/c19-16-8-9-22-15(10-18(16)11-17(20)21)14-7-3-5-12-4-1-2-6-13(12)14/h1-7,15H,8-11H2,(H,20,21)