[(E)-3-phenylprop-2-enyl] (2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [(E)-3-phenylprop-2-enyl] (2S)-2-[(2,4-dichlorophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [(E)-cinnamyl] (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-3-methylbutanoic acid [(E)-3-phenylprop-2-enyl] ester IUPAC Name: [(E)-3-phenylprop-2-enyl] (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2,4-dichlorobenzoyl)amino]-3-methyl-butyric acid [(E)-cinnamyl] ester Formula: C21H21Cl2NO3 MolecularWeight: 406.30234

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC=CC1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)[C@@H](C(=O)OC/C=C/C1=CC=CC=C1)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C21H21Cl2NO3/c1-14(2)19(24-20(25)17-11-10-16(22)13-18(17)23)21(26)27-12-6-9-15-7-4-3-5-8-15/h3-11,13-14,19H,12H2,1-2H3,(H,24,25)/b9-6+/t19-/m0/s1