1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide CAS Name: 1-(4-ethoxy-3-methylphenyl)sulfonyl-N-[(4-sulfamoylphenyl)methyl]-4-piperidinecarboxamide IUPAC Name: 1-(4-ethoxy-3-methylphenyl)sulfonyl-N-[(4-sulfamoylphenyl)methyl]piperidine-4-carboxamide Traditional Name: 1-(4-ethoxy-3-methyl-phenyl)sulfonyl-N-(4-sulfamoylbenzyl)isonipecotamide Formula: C22H29N3O6S2 MolecularWeight: 495.61216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3=CC=C(C=C3)S(=O)(=O)N)C

InChI

InChI=1S/C22H29N3O6S2/c1-3-31-21-9-8-20(14-16(21)2)33(29,30)25-12-10-18(11-13-25)22(26)24-15-17-4-6-19(7-5-17)32(23,27)28/h4-9,14,18H,3,10-13,15H2,1-2H3,(H,24,26)(H2,23,27,28)