N-[[3-(methylcarbamoyl)phenyl]methyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[3-(methylcarbamoyl)benzyl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=CC(=C3)C(=O)NC

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NCC3=CC=CC(=C3)C(=O)NC

InChI

InChI=1S/C22H26N4O4/c1-15-8-10-25(11-9-15)20-7-6-18(26(29)30)13-19(20)22(28)24-14-16-4-3-5-17(12-16)21(27)23-2/h3-7,12-13,15H,8-11,14H2,1-2H3,(H,23,27)(H,24,28)