3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-piperidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]-4-piperidin-1-yl-benzamide Openeye Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-(4-benzoyl-1-piperazinyl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-(4-benzoylpiperazino)phenyl]-3-nitro-4-piperidino-benzamide Formula: C29H31N5O4 MolecularWeight: 513.58754

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)N4CCN(CC4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H31N5O4/c35-28(23-9-14-26(27(21-23)34(37)38)32-15-5-2-6-16-32)30-24-10-12-25(13-11-24)31-17-19-33(20-18-31)29(36)22-7-3-1-4-8-22/h1,3-4,7-14,21H,2,5-6,15-20H2,(H,30,35)