3-(1-azanylpropan-2-yl)-4-phenoxy-5-sulfamoyl-benzoic acid

Systemtic Name: 3-(1-azanylpropan-2-yl)-4-phenoxy-5-sulfamoyl-benzoic acid Openeye Name: 3-(2-amino-1-methyl-ethyl)-4-phenoxy-5-sulfamoyl-benzoic acid CAS Name: 3-(1-aminopropan-2-yl)-4-phenoxy-5-sulfamoylbenzoic acid IUPAC Name: 3-(1-aminopropan-2-yl)-4-phenoxy-5-sulfamoylbenzoic acid Traditional Name: 3-(2-amino-1-methyl-ethyl)-4-phenoxy-5-sulfamoyl-benzoic acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN)C1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

Isomeric SMILES

CC(CN)C1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=CC=C2

InChI

InChI=1S/C16H18N2O5S/c1-10(9-17)13-7-11(16(19)20)8-14(24(18,21)22)15(13)23-12-5-3-2-4-6-12/h2-8,10H,9,17H2,1H3,(H,19,20)(H2,18,21,22)