[(E)-3-phenylprop-2-enyl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: [(E)-cinnamyl] 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid [(E)-cinnamyl] ester Formula: C21H23NO3S MolecularWeight: 369.47722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OCC=CC2=CC=CC=C2

Isomeric SMILES

CC(C)NC(=O)CSC1=CC=CC=C1C(=O)OC/C=C/C2=CC=CC=C2

InChI

InChI=1S/C21H23NO3S/c1-16(2)22-20(23)15-26-19-13-7-6-12-18(19)21(24)25-14-8-11-17-9-4-3-5-10-17/h3-13,16H,14-15H2,1-2H3,(H,22,23)/b11-8+