N-(5-chloranylpyridin-2-yl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C18H19ClN4O5S MolecularWeight: 438.88526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4O5S/c1-12-2-4-15(23(25)26)10-16(12)29(27,28)22-8-6-13(7-9-22)18(24)21-17-5-3-14(19)11-20-17/h2-5,10-11,13H,6-9H2,1H3,(H,20,21,24)