[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] (E)-2-(4-chlorophenyl)-3-phenyl-prop-2-enoate CAS Name: (E)-2-(4-chlorophenyl)-3-phenyl-2-propenoic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] (E)-2-(4-chlorophenyl)-3-phenylprop-2-enoate Traditional Name: (E)-2-(4-chlorophenyl)-3-phenyl-acrylic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C21H22ClNO3 MolecularWeight: 371.85728

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C(=CC1=CC=CC=C1)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)NC(=O)COC(=O)/C(=C/C1=CC=CC=C1)/C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H22ClNO3/c1-3-15(2)23-20(24)14-26-21(25)19(13-16-7-5-4-6-8-16)17-9-11-18(22)12-10-17/h4-13,15H,3,14H2,1-2H3,(H,23,24)/b19-13+