butyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]carbonylamino]benzoate

Systemtic Name: butyl 2-[[4-(4-nitrophenyl)piperazin-1-yl]carbonylamino]benzoate Openeye Name: butyl 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]benzoate CAS Name: 2-[[[4-(4-nitrophenyl)-1-piperazinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]benzoate Traditional Name: 2-[[4-(4-nitrophenyl)piperazine-1-carbonyl]amino]benzoic acid butyl ester Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1NC(=O)N2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O5/c1-2-3-16-31-21(27)19-6-4-5-7-20(19)23-22(28)25-14-12-24(13-15-25)17-8-10-18(11-9-17)26(29)30/h4-11H,2-3,12-16H2,1H3,(H,23,28)