N-[1-[4-(azepan-1-yl)-3-nitro-phenyl]carbonylpiperidin-4-yl]benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)C(=O)N3CCC(CC3)NC(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O4/c30-24(19-8-4-3-5-9-19)26-21-12-16-28(17-13-21)25(31)20-10-11-22(23(18-20)29(32)33)27-14-6-1-2-7-15-27/h3-5,8-11,18,21H,1-2,6-7,12-17H2,(H,26,30)