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

Systemtic Name: N-(4,5-dimethoxy-2-methyl-phenyl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-(4,5-dimethoxy-2-methyl-phenyl)-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-(4,5-dimethoxy-2-methylphenyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(4,5-dimethoxy-2-methylphenyl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-(4,5-dimethoxy-2-methyl-phenyl)-3-nitro-4-piperidino-benzamide Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])OC)OC

Isomeric SMILES

CC1=CC(=C(C=C1NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C21H25N3O5/c1-14-11-19(28-2)20(29-3)13-16(14)22-21(25)15-7-8-17(18(12-15)24(26)27)23-9-5-4-6-10-23/h7-8,11-13H,4-6,9-10H2,1-3H3,(H,22,25)