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

Systemtic Name: N-[1-[(2-chloranyl-5-nitro-phenyl)methyl]piperidin-4-yl]-N-(3-methylphenyl)benzamide Openeye Name: N-[1-[(2-chloro-5-nitro-phenyl)methyl]-4-piperidyl]-N-(m-tolyl)benzamide CAS Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]-4-piperidinyl]-N-(3-methylphenyl)benzamide IUPAC Name: N-[1-[(2-chloro-5-nitrophenyl)methyl]piperidin-4-yl]-N-(3-methylphenyl)benzamide Traditional Name: N-[1-(2-chloro-5-nitro-benzyl)-4-piperidyl]-N-(m-tolyl)benzamide Formula: C26H26ClN3O3 MolecularWeight: 463.95594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2CCN(CC2)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N(C2CCN(CC2)CC3=C(C=CC(=C3)[N+](=O)[O-])Cl)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H26ClN3O3/c1-19-6-5-9-23(16-19)29(26(31)20-7-3-2-4-8-20)22-12-14-28(15-13-22)18-21-17-24(30(32)33)10-11-25(21)27/h2-11,16-17,22H,12-15,18H2,1H3