ethyl 4-[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[1-(2-nitrophenyl)piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[1-(2-nitrophenyl)-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[1-(2-nitrophenyl)piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[1-(2-nitrophenyl)isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H28N4O5 MolecularWeight: 404.46012

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2CCN(CC2)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O5/c1-2-29-20(26)23-13-9-16(10-14-23)21-19(25)15-7-11-22(12-8-15)17-5-3-4-6-18(17)24(27)28/h3-6,15-16H,2,7-14H2,1H3,(H,21,25)