ethyl 1-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-(4-anilino-3-nitro-benzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-anilino-3-nitrophenyl)-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(4-anilino-3-nitrobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-anilino-3-nitro-benzoyl)isonipecotic acid ethyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-2-29-21(26)15-10-12-23(13-11-15)20(25)16-8-9-18(19(14-16)24(27)28)22-17-6-4-3-5-7-17/h3-9,14-15,22H,2,10-13H2,1H3