azepan-1-yl-[1-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-(3-nitro-4-phenylazanyl-phenyl)carbonylpiperidin-4-yl]methanone Openeye Name: [1-(4-anilino-3-nitro-benzoyl)-4-piperidyl]-(azepan-1-yl)methanone CAS Name: [1-[(4-anilino-3-nitrophenyl)-oxomethyl]-4-piperidinyl]-(1-azepanyl)methanone IUPAC Name: [1-(4-anilino-3-nitrobenzoyl)piperidin-4-yl]-(azepan-1-yl)methanone Traditional Name: [1-(4-anilino-3-nitro-benzoyl)-4-piperidyl]-(azepan-1-yl)methanone Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c30-24(27-14-6-1-2-7-15-27)19-12-16-28(17-13-19)25(31)20-10-11-22(23(18-20)29(32)33)26-21-8-4-3-5-9-21/h3-5,8-11,18-19,26H,1-2,6-7,12-17H2