N-(4,5-dimethoxy-2-methyl-phenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(4,5-dimethoxy-2-methylphenyl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(4,5-dimethoxy-2-methylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(4,5-dimethoxy-2-methyl-phenyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3C)OC)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3C)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O5/c1-14-6-5-9-24(13-14)18-8-7-16(11-19(18)25(27)28)22(26)23-17-12-21(30-4)20(29-3)10-15(17)2/h7-8,10-12,14H,5-6,9,13H2,1-4H3,(H,23,26)