2-(1-benzothiophen-3-ylmethyl)-4-oxidanylidene-4-phenyl-butanoic acid

Systemtic Name: 2-(1-benzothiophen-3-ylmethyl)-4-oxidanylidene-4-phenyl-butanoic acid Openeye Name: 2-(benzothiophen-3-ylmethyl)-4-oxo-4-phenyl-butanoic acid CAS Name: 2-(1-benzothiophen-3-ylmethyl)-4-oxo-4-phenylbutanoic acid IUPAC Name: 2-(1-benzothiophen-3-ylmethyl)-4-oxo-4-phenylbutanoic acid Traditional Name: 2-(benzothiophen-3-ylmethyl)-4-keto-4-phenyl-butyric acid Formula: C19H16O3S MolecularWeight: 324.39354

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)CC(CC2=CSC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)CC(CC2=CSC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C19H16O3S/c20-17(13-6-2-1-3-7-13)11-14(19(21)22)10-15-12-23-18-9-5-4-8-16(15)18/h1-9,12,14H,10-11H2,(H,21,22)