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

Systemtic Name: 3-nitro-N-[4-[4-(phenylmethyl)piperazin-1-yl]phenyl]-4-piperidin-1-yl-benzamide Openeye Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: 3-nitro-N-[4-[4-(phenylmethyl)-1-piperazinyl]phenyl]-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-(4-benzylpiperazin-1-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-(4-benzylpiperazino)phenyl]-3-nitro-4-piperidino-benzamide Formula: C29H33N5O3 MolecularWeight: 499.60402

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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)CC5=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)CC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H33N5O3/c35-29(24-9-14-27(28(21-24)34(36)37)33-15-5-2-6-16-33)30-25-10-12-26(13-11-25)32-19-17-31(18-20-32)22-23-7-3-1-4-8-23/h1,3-4,7-14,21H,2,5-6,15-20,22H2,(H,30,35)