ethyl 4-[(3-nitro-4-phenylazanyl-phenyl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(3-nitro-4-phenylazanyl-phenyl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(4-anilino-3-nitro-benzoyl)amino]piperidine-1-carboxylate CAS Name: 4-[[(4-anilino-3-nitrophenyl)-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-anilino-3-nitrobenzoyl)amino]piperidine-1-carboxylate Traditional Name: 4-[(4-anilino-3-nitro-benzoyl)amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-2-30-21(27)24-12-10-17(11-13-24)23-20(26)15-8-9-18(19(14-15)25(28)29)22-16-6-4-3-5-7-16/h3-9,14,17,22H,2,10-13H2,1H3,(H,23,26)