N-(2,5-dimethylphenyl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(2,5-dimethylphenyl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(2,5-dimethylphenyl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(2,5-dimethylphenyl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(2,5-dimethylphenyl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(2,5-dimethylphenyl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=C(C=CC(=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-14-8-10-23(11-9-14)19-7-6-17(13-20(19)24(26)27)21(25)22-18-12-15(2)4-5-16(18)3/h4-7,12-14H,8-11H2,1-3H3,(H,22,25)