N-(1,3-benzodioxol-5-yl)-1-(2-methoxy-5-sulfamoyl-phenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(2-methoxy-5-sulfamoyl-phenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzodioxol-5-yl)-1-(2-methoxy-5-sulfamoyl-benzoyl)piperidine-4-carboxamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-[(2-methoxy-5-sulfamoylphenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-(2-methoxy-5-sulfamoylbenzoyl)piperidine-4-carboxamide Traditional Name: N-(1,3-benzodioxol-5-yl)-1-(2-methoxy-5-sulfamoyl-benzoyl)isonipecotamide Formula: C21H23N3O7S MolecularWeight: 461.48822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)N2CCC(CC2)C(=O)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23N3O7S/c1-29-17-5-3-15(32(22,27)28)11-16(17)21(26)24-8-6-13(7-9-24)20(25)23-14-2-4-18-19(10-14)31-12-30-18/h2-5,10-11,13H,6-9,12H2,1H3,(H,23,25)(H2,22,27,28)