[1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-phenylethanoylamino)propanoate

Systemtic Name: [1-[(2,4-dimethylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3-(2-phenylethanoylamino)propanoate Openeye Name: [2-(2,4-dimethylanilino)-1-methyl-2-oxo-ethyl] 3-[(2-phenylacetyl)amino]propanoate CAS Name: 3-[(1-oxo-2-phenylethyl)amino]propanoic acid [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(2,4-dimethylanilino)-1-oxopropan-2-yl] 3-[(2-phenylacetyl)amino]propanoate Traditional Name: 3-[(2-phenylacetyl)amino]propionic acid [2-(2,4-dimethylanilino)-2-keto-1-methyl-ethyl] ester Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)CCNC(=O)CC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C(C)OC(=O)CCNC(=O)CC2=CC=CC=C2)C

InChI

InChI=1S/C22H26N2O4/c1-15-9-10-19(16(2)13-15)24-22(27)17(3)28-21(26)11-12-23-20(25)14-18-7-5-4-6-8-18/h4-10,13,17H,11-12,14H2,1-3H3,(H,23,25)(H,24,27)