N-(2,4-dimethylphenyl)-4-[(3R)-3-methylpiperidin-1-yl]-3-nitro-benzamide

Systemtic Name: N-(2,4-dimethylphenyl)-4-[(3R)-3-methylpiperidin-1-yl]-3-nitro-benzamide Openeye Name: N-(2,4-dimethylphenyl)-4-[(3R)-3-methyl-1-piperidyl]-3-nitro-benzamide CAS Name: N-(2,4-dimethylphenyl)-4-[(3R)-3-methyl-1-piperidinyl]-3-nitrobenzamide IUPAC Name: N-(2,4-dimethylphenyl)-4-[(3R)-3-methylpiperidin-1-yl]-3-nitrobenzamide Traditional Name: N-(2,4-dimethylphenyl)-4-[(3R)-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=C(C=C(C=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

C[C@@H]1CCCN(C1)C2=C(C=C(C=C2)C(=O)NC3=C(C=C(C=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H25N3O3/c1-14-6-8-18(16(3)11-14)22-21(25)17-7-9-19(20(12-17)24(26)27)23-10-4-5-15(2)13-23/h6-9,11-12,15H,4-5,10,13H2,1-3H3,(H,22,25)/t15-/m1/s1