4-fluoranyl-N-[1-(2-methoxy-4-nitro-phenyl)sulfonylpiperidin-4-yl]benzamide

Systemtic Name: 4-fluoranyl-N-[1-(2-methoxy-4-nitro-phenyl)sulfonylpiperidin-4-yl]benzamide Openeye Name: 4-fluoro-N-[1-(2-methoxy-4-nitro-phenyl)sulfonyl-4-piperidyl]benzamide CAS Name: 4-fluoro-N-[1-(2-methoxy-4-nitrophenyl)sulfonyl-4-piperidinyl]benzamide IUPAC Name: 4-fluoro-N-[1-(2-methoxy-4-nitrophenyl)sulfonylpiperidin-4-yl]benzamide Traditional Name: 4-fluoro-N-[1-(2-methoxy-4-nitro-phenyl)sulfonyl-4-piperidyl]benzamide Formula: C19H20FN3O6S MolecularWeight: 437.442003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C19H20FN3O6S/c1-29-17-12-16(23(25)26)6-7-18(17)30(27,28)22-10-8-15(9-11-22)21-19(24)13-2-4-14(20)5-3-13/h2-7,12,15H,8-11H2,1H3,(H,21,24)