N-[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]phenyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[3-chloro-4-[4-(2-chlorobenzyl)piperazino]phenyl]-5-nitro-2-piperidino-benzamide Formula: C29H31Cl2N5O3 MolecularWeight: 568.49414

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5Cl)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)N4CCN(CC4)CC5=CC=CC=C5Cl)Cl

InChI

InChI=1S/C29H31Cl2N5O3/c30-25-7-3-2-6-21(25)20-33-14-16-35(17-15-33)28-10-8-22(18-26(28)31)32-29(37)24-19-23(36(38)39)9-11-27(24)34-12-4-1-5-13-34/h2-3,6-11,18-19H,1,4-5,12-17,20H2,(H,32,37)