4-methoxy-3-pyrrolidin-1-ylsulfonyl-N-[(4-sulfamoylphenyl)methyl]benzamide

Systemtic Name: 4-methoxy-3-pyrrolidin-1-ylsulfonyl-N-[(4-sulfamoylphenyl)methyl]benzamide Openeye Name: 4-methoxy-3-pyrrolidin-1-ylsulfonyl-N-[(4-sulfamoylphenyl)methyl]benzamide CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)-N-[(4-sulfamoylphenyl)methyl]benzamide IUPAC Name: 4-methoxy-3-pyrrolidin-1-ylsulfonyl-N-[(4-sulfamoylphenyl)methyl]benzamide Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-N-(4-sulfamoylbenzyl)benzamide Formula: C19H23N3O6S2 MolecularWeight: 453.53242

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC2=CC=C(C=C2)S(=O)(=O)N)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H23N3O6S2/c1-28-17-9-6-15(12-18(17)30(26,27)22-10-2-3-11-22)19(23)21-13-14-4-7-16(8-5-14)29(20,24)25/h4-9,12H,2-3,10-11,13H2,1H3,(H,21,23)(H2,20,24,25)