[2-oxidanylidene-2-[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]amino]ethyl] 2-methylbutanoate

Systemtic Name: [2-oxidanylidene-2-[[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]amino]ethyl] 2-methylbutanoate Openeye Name: [2-[4-(4-benzylpiperazin-1-yl)anilino]-2-oxo-ethyl] 2-methylbutanoate CAS Name: 2-methylbutanoic acid [2-oxo-2-[4-[4-(phenylmethyl)-1-piperazinyl]anilino]ethyl] ester IUPAC Name: [2-[4-(4-benzylpiperazin-1-yl)anilino]-2-oxoethyl] 2-methylbutanoate Traditional Name: 2-methylbutyric acid [2-[4-(4-benzylpiperazino)anilino]-2-keto-ethyl] ester Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)OCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(=O)OCC(=O)NC1=CC=C(C=C1)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O3/c1-3-19(2)24(29)30-18-23(28)25-21-9-11-22(12-10-21)27-15-13-26(14-16-27)17-20-7-5-4-6-8-20/h4-12,19H,3,13-18H2,1-2H3,(H,25,28)