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

Systemtic Name: 4-methyl-N-[4-(4-methylpiperidin-1-yl)-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[4-(4-methyl-1-piperidyl)-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[4-(4-methyl-1-piperidinyl)-3-[oxo-(1-phenylethylamino)methyl]phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[4-(4-methylpiperidin-1-yl)-3-(1-phenylethylcarbamoyl)phenyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[4-(4-methylpiperidino)-3-(1-phenylethylcarbamoyl)phenyl]-3-nitro-benzamide Formula: C29H32N4O4 MolecularWeight: 500.58878

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C29H32N4O4/c1-19-13-15-32(16-14-19)26-12-11-24(31-28(34)23-10-9-20(2)27(17-23)33(36)37)18-25(26)29(35)30-21(3)22-7-5-4-6-8-22/h4-12,17-19,21H,13-16H2,1-3H3,(H,30,35)(H,31,34)