4-(3,5-dimethylpiperidin-1-yl)-N-(2-ethylphenyl)-3-nitro-benzamide

Systemtic Name: 4-(3,5-dimethylpiperidin-1-yl)-N-(2-ethylphenyl)-3-nitro-benzamide Openeye Name: 4-(3,5-dimethyl-1-piperidyl)-N-(2-ethylphenyl)-3-nitro-benzamide CAS Name: 4-(3,5-dimethyl-1-piperidinyl)-N-(2-ethylphenyl)-3-nitrobenzamide IUPAC Name: 4-(3,5-dimethylpiperidin-1-yl)-N-(2-ethylphenyl)-3-nitrobenzamide Traditional Name: 4-(3,5-dimethylpiperidino)-N-(2-ethylphenyl)-3-nitro-benzamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CC(CC(C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)N3CC(CC(C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C22H27N3O3/c1-4-17-7-5-6-8-19(17)23-22(26)18-9-10-20(21(12-18)25(27)28)24-13-15(2)11-16(3)14-24/h5-10,12,15-16H,4,11,13-14H2,1-3H3,(H,23,26)