2-naphthalen-2-ylsulfanyl-4-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: 2-naphthalen-2-ylsulfanyl-4-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 2-(2-naphthylsulfanyl)-4-oxo-4-phenyl-butanoic acid CAS Name: 2-(2-naphthalenylthio)-4-oxo-4-phenylbutanoic acid IUPAC Name: 2-naphthalen-2-ylsulfanyl-4-oxo-4-phenylbutanoic acid Traditional Name: 4-keto-2-(2-naphthylthio)-4-phenyl-butyric acid Formula: C20H16O3S MolecularWeight: 336.40424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(C(=O)O)SC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C20H16O3S/c21-18(15-7-2-1-3-8-15)13-19(20(22)23)24-17-11-10-14-6-4-5-9-16(14)12-17/h1-12,19H,13H2,(H,22,23)