methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate

Systemtic Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate Openeye Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoyl-benzoate CAS Name: 4-phenoxy-3-(1-pyrrolidinyl)-5-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-phenoxy-3-pyrrolidin-1-yl-5-sulfamoylbenzoate Traditional Name: 4-phenoxy-3-pyrrolidino-5-sulfamoyl-benzoic acid methyl ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

Isomeric SMILES

COC(=O)C1=CC(=C(C(=C1)S(=O)(=O)N)OC2=CC=CC=C2)N3CCCC3

InChI

InChI=1S/C18H20N2O5S/c1-24-18(21)13-11-15(20-9-5-6-10-20)17(16(12-13)26(19,22)23)25-14-7-3-2-4-8-14/h2-4,7-8,11-12H,5-6,9-10H2,1H3,(H2,19,22,23)