[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-[(3-methylphenyl)carbonylamino]propanoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-[(3-methylphenyl)carbonylamino]propanoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-[(3-methylbenzoyl)amino]propanoate CAS Name: 2-[[(3-methylphenyl)-oxomethyl]amino]propanoic acid [1-oxo-1-(4-phenyl-1-piperazinyl)propan-2-yl] ester IUPAC Name: [1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-[(3-methylbenzoyl)amino]propanoate Traditional Name: 2-(m-toluoylamino)propionic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C24H29N3O4 MolecularWeight: 423.50476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(C)C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O4/c1-17-8-7-9-20(16-17)22(28)25-18(2)24(30)31-19(3)23(29)27-14-12-26(13-15-27)21-10-5-4-6-11-21/h4-11,16,18-19H,12-15H2,1-3H3,(H,25,28)