N-[1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-yl]benzamide

Systemtic Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonylpiperidin-4-yl]benzamide Openeye Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonyl-4-piperidyl]benzamide CAS Name: N-[1-(2-methoxy-5-nitrophenyl)sulfonyl-4-piperidinyl]benzamide IUPAC Name: N-[1-(2-methoxy-5-nitrophenyl)sulfonylpiperidin-4-yl]benzamide Traditional Name: N-[1-(2-methoxy-5-nitro-phenyl)sulfonyl-4-piperidyl]benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21N3O6S/c1-28-17-8-7-16(22(24)25)13-18(17)29(26,27)21-11-9-15(10-12-21)20-19(23)14-5-3-2-4-6-14/h2-8,13,15H,9-12H2,1H3,(H,20,23)