N-(3,5-dimethylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(3,5-dimethylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(3,5-dimethylphenyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(3,5-dimethylphenyl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(3,5-dimethylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(3,5-dimethylphenyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-14-5-4-8-23(13-14)19-7-6-17(12-20(19)24(26)27)21(25)22-18-10-15(2)9-16(3)11-18/h6-7,9-12,14H,4-5,8,13H2,1-3H3,(H,22,25)