[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-methyl-2-[(2-methylphenyl)carbonylamino]pentanoate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 4-methyl-2-[(2-methylphenyl)carbonylamino]pentanoate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 4-methyl-2-[(2-methylbenzoyl)amino]pentanoate CAS Name: 4-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]pentanoic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 4-methyl-2-[(2-methylbenzoyl)amino]pentanoate Traditional Name: 4-methyl-2-(o-toluoylamino)valeric acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(CC(C)C)C(=O)OCC(=O)NC2=CC=CC(=C2)C#N

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(CC(C)C)C(=O)OCC(=O)NC2=CC=CC(=C2)C#N

InChI

InChI=1S/C23H25N3O4/c1-15(2)11-20(26-22(28)19-10-5-4-7-16(19)3)23(29)30-14-21(27)25-18-9-6-8-17(12-18)13-24/h4-10,12,15,20H,11,14H2,1-3H3,(H,25,27)(H,26,28)