ethyl 4-[[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)phenyl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[3-nitro-4-[4-(2-pyridyl)piperazin-1-yl]benzoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[3-nitro-4-[4-(2-pyridinyl)-1-piperazinyl]phenyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[3-nitro-4-(4-pyridin-2-ylpiperazin-1-yl)benzoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[3-nitro-4-[4-(2-pyridyl)piperazino]benzoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C24H30N6O5 MolecularWeight: 482.5322

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C4=CC=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C24H30N6O5/c1-2-35-24(32)29-11-8-19(9-12-29)26-23(31)18-6-7-20(21(17-18)30(33)34)27-13-15-28(16-14-27)22-5-3-4-10-25-22/h3-7,10,17,19H,2,8-9,11-16H2,1H3,(H,26,31)