N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-[4-(2-chlorobenzyl)piperazino]phenyl]-3-nitro-4-piperidino-benzamide Formula: C29H32ClN5O3 MolecularWeight: 534.04908

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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=C5Cl)[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=C5Cl)[N+](=O)[O-]

InChI

InChI=1S/C29H32ClN5O3/c30-26-7-3-2-6-23(26)21-32-16-18-33(19-17-32)25-11-9-24(10-12-25)31-29(36)22-8-13-27(28(20-22)35(37)38)34-14-4-1-5-15-34/h2-3,6-13,20H,1,4-5,14-19,21H2,(H,31,36)