2-chloranyl-N-(2-methyl-5-nitro-phenyl)-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-(2-methyl-5-nitro-phenyl)-5-(4-methylpiperidin-1-yl)sulfonyl-benzamide Openeye Name: 2-chloro-N-(2-methyl-5-nitro-phenyl)-5-[(4-methyl-1-piperidyl)sulfonyl]benzamide CAS Name: 2-chloro-N-(2-methyl-5-nitrophenyl)-5-[(4-methyl-1-piperidinyl)sulfonyl]benzamide IUPAC Name: 2-chloro-N-(2-methyl-5-nitrophenyl)-5-(4-methylpiperidin-1-yl)sulfonylbenzamide Traditional Name: 2-chloro-N-(2-methyl-5-nitro-phenyl)-5-(4-methylpiperidino)sulfonyl-benzamide Formula: C20H22ClN3O5S MolecularWeight: 451.92378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22ClN3O5S/c1-13-7-9-23(10-8-13)30(28,29)16-5-6-18(21)17(12-16)20(25)22-19-11-15(24(26)27)4-3-14(19)2/h3-6,11-13H,7-10H2,1-2H3,(H,22,25)