[1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (Z)-2-acetamido-3-phenyl-prop-2-enoate

Systemtic Name: [1-[(2-butan-2-ylphenyl)amino]-1-oxidanylidene-propan-2-yl] (Z)-2-acetamido-3-phenyl-prop-2-enoate Openeye Name: [1-methyl-2-oxo-2-(2-sec-butylanilino)ethyl] (Z)-2-acetamido-3-phenyl-prop-2-enoate CAS Name: (Z)-2-acetamido-3-phenyl-2-propenoic acid [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2-butan-2-ylanilino)-1-oxopropan-2-yl] (Z)-2-acetamido-3-phenylprop-2-enoate Traditional Name: (Z)-2-acetamido-3-phenyl-acrylic acid [2-keto-1-methyl-2-(2-sec-butylanilino)ethyl] ester Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)C(=CC2=CC=CC=C2)NC(=O)C

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)OC(=O)/C(=C/C2=CC=CC=C2)/NC(=O)C

InChI

InChI=1S/C24H28N2O4/c1-5-16(2)20-13-9-10-14-21(20)26-23(28)17(3)30-24(29)22(25-18(4)27)15-19-11-7-6-8-12-19/h6-17H,5H2,1-4H3,(H,25,27)(H,26,28)/b22-15-