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

Systemtic Name: 3-naphthalen-2-ylsulfanyl-4-phenyl-butanoic acid Openeye Name: 3-(2-naphthylsulfanyl)-4-phenyl-butanoic acid CAS Name: 3-(2-naphthalenylthio)-4-phenylbutanoic acid IUPAC Name: 3-naphthalen-2-ylsulfanyl-4-phenylbutanoic acid Traditional Name: 3-(2-naphthylthio)-4-phenyl-butyric acid Formula: C20H18O2S MolecularWeight: 322.42072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O2S/c21-20(22)14-19(12-15-6-2-1-3-7-15)23-18-11-10-16-8-4-5-9-17(16)13-18/h1-11,13,19H,12,14H2,(H,21,22)