N-(3-chloranyl-2-methyl-phenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-4-(3-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-4-(3-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(3-chloro-2-methylphenyl)-4-(3-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(3-chloro-2-methylphenyl)-4-(3-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-4-(3-methylpiperidino)-3-nitro-benzamide Formula: C20H22ClN3O3 MolecularWeight: 387.85998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O3/c1-13-5-4-10-23(12-13)18-9-8-15(11-19(18)24(26)27)20(25)22-17-7-3-6-16(21)14(17)2/h3,6-9,11,13H,4-5,10,12H2,1-2H3,(H,22,25)