3-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoate

Systemtic Name: 3-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoate Openeye Name: 3-[(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)sulfamoyl]benzoate CAS Name: 3-[[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]sulfamoyl]benzoate IUPAC Name: 3-[(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)sulfamoyl]benzoate Formula: C19H21N2O7S2- MolecularWeight: 453.50924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-])S(=O)(=O)N3CCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)[O-])S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H22N2O7S2/c1-2-28-17-9-8-15(13-18(17)30(26,27)21-10-3-4-11-21)20-29(24,25)16-7-5-6-14(12-16)19(22)23/h5-9,12-13,20H,2-4,10-11H2,1H3,(H,22,23)/p-1