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

Systemtic Name: N-(4-chloranyl-3-cyano-phenyl)-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-(4-chloro-3-cyano-phenyl)-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-(4-chloro-3-cyanophenyl)-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-(4-chloro-3-cyanophenyl)-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-(4-chloro-3-cyano-phenyl)-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN4O3/c1-13-6-8-24(9-7-13)18-5-2-14(11-19(18)25(27)28)20(26)23-16-3-4-17(21)15(10-16)12-22/h2-5,10-11,13H,6-9H2,1H3,(H,23,26)