[4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone

Systemtic Name: [4-(4-nitro-3-piperidin-1-yl-phenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone Openeye Name: (4-benzyloxyphenyl)-[4-[4-nitro-3-(1-piperidyl)phenyl]piperazin-1-yl]methanone CAS Name: [4-[4-nitro-3-(1-piperidinyl)phenyl]-1-piperazinyl]-(4-phenylmethoxyphenyl)methanone IUPAC Name: [4-(4-nitro-3-piperidin-1-ylphenyl)piperazin-1-yl]-(4-phenylmethoxyphenyl)methanone Traditional Name: (4-benzoxyphenyl)-[4-(4-nitro-3-piperidino-phenyl)piperazino]methanone Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=CC(=C2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)OCC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H32N4O4/c34-29(24-9-12-26(13-10-24)37-22-23-7-3-1-4-8-23)32-19-17-30(18-20-32)25-11-14-27(33(35)36)28(21-25)31-15-5-2-6-16-31/h1,3-4,7-14,21H,2,5-6,15-20,22H2