[1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-(butylamino)benzoate

Systemtic Name: [1-oxidanylidene-1-(4-phenylpiperazin-1-yl)propan-2-yl] 2-(butylamino)benzoate Openeye Name: [1-methyl-2-oxo-2-(4-phenylpiperazin-1-yl)ethyl] 2-(butylamino)benzoate CAS Name: 2-(butylamino)benzoic 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-(butylamino)benzoate Traditional Name: 2-(butylamino)benzoic acid [2-keto-1-methyl-2-(4-phenylpiperazino)ethyl] ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=CC=CC=C1C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC1=CC=CC=C1C(=O)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-3-4-14-25-22-13-9-8-12-21(22)24(29)30-19(2)23(28)27-17-15-26(16-18-27)20-10-6-5-7-11-20/h5-13,19,25H,3-4,14-18H2,1-2H3