N-[[3-(dimethylcarbamoyl)phenyl]methyl]-4-(3,5-dimethylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-4-(3,5-dimethylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-4-(3,5-dimethyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[[3-[dimethylamino(oxo)methyl]phenyl]methyl]-4-(3,5-dimethyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[[3-(dimethylcarbamoyl)phenyl]methyl]-4-(3,5-dimethylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-(dimethylcarbamoyl)benzyl]-4-(3,5-dimethylpiperidino)-3-nitro-benzamide Formula: C24H30N4O4 MolecularWeight: 438.5194

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC(=C3)C(=O)N(C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CC(=C3)C(=O)N(C)C)[N+](=O)[O-])C

InChI

InChI=1S/C24H30N4O4/c1-16-10-17(2)15-27(14-16)21-9-8-19(12-22(21)28(31)32)23(29)25-13-18-6-5-7-20(11-18)24(30)26(3)4/h5-9,11-12,16-17H,10,13-15H2,1-4H3,(H,25,29)