[4-(4-cyanophenyl)phenyl] 2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-[(3,5-dimethoxyphenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butanoate CAS Name: 2-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-methylbutanoic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-[(3,5-dimethoxybenzoyl)amino]-3-methylbutanoate Traditional Name: 2-[(3,5-dimethoxybenzoyl)amino]-3-methyl-butyric acid [4-(4-cyanophenyl)phenyl] ester Formula: C27H26N2O5 MolecularWeight: 458.50574

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)NC(=O)C3=CC(=CC(=C3)OC)OC

Isomeric SMILES

CC(C)C(C(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C#N)NC(=O)C3=CC(=CC(=C3)OC)OC

InChI

InChI=1S/C27H26N2O5/c1-17(2)25(29-26(30)21-13-23(32-3)15-24(14-21)33-4)27(31)34-22-11-9-20(10-12-22)19-7-5-18(16-28)6-8-19/h5-15,17,25H,1-4H3,(H,29,30)