3-[2-(phenylmethyl)phenyl]-3-sulfanylidene-propanoate

Systemtic Name: 3-[2-(phenylmethyl)phenyl]-3-sulfanylidene-propanoate Openeye Name: 3-(2-benzylphenyl)-3-thioxo-propanoate CAS Name: 3-[2-(phenylmethyl)phenyl]-3-sulfanylidenepropanoate IUPAC Name: 3-(2-benzylphenyl)-3-sulfanylidenepropanoate Traditional Name: 3-(2-benzylphenyl)-3-thioxo-propionate Formula: C16H13O2S- MolecularWeight: 269.33822

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=CC=C2C(=S)CC(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=CC=C2C(=S)CC(=O)[O-]

InChI

InChI=1S/C16H14O2S/c17-16(18)11-15(19)14-9-5-4-8-13(14)10-12-6-2-1-3-7-12/h1-9H,10-11H2,(H,17,18)/p-1