N-[(4-methylphenyl)methyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: 4-(3-methyl-1-piperidyl)-3-nitro-N-(p-tolylmethyl)benzamide CAS Name: N-[(4-methylphenyl)methyl]-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(4-methylbenzyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-15-5-7-17(8-6-15)13-22-21(25)18-9-10-19(20(12-18)24(26)27)23-11-3-4-16(2)14-23/h5-10,12,16H,3-4,11,13-14H2,1-2H3,(H,22,25)