propyl 4-[[4-(3-methylphenyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[4-(3-methylphenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: propyl 4-[[4-(m-tolyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 4-[[[4-(3-methylphenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[4-(3-methylphenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 4-[[4-(m-tolyl)piperazine-1-carbonyl]amino]benzoic acid propyl ester Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)C3=CC=CC(=C3)C

InChI

InChI=1S/C22H27N3O3/c1-3-15-28-21(26)18-7-9-19(10-8-18)23-22(27)25-13-11-24(12-14-25)20-6-4-5-17(2)16-20/h4-10,16H,3,11-15H2,1-2H3,(H,23,27)