4-butyl-2-[1-(furan-2-yl)ethylamino]-5-sulfamoyl-benzoic acid

Systemtic Name: 4-butyl-2-[1-(furan-2-yl)ethylamino]-5-sulfamoyl-benzoic acid Openeye Name: 4-butyl-2-[1-(2-furyl)ethylamino]-5-sulfamoyl-benzoic acid CAS Name: 4-butyl-2-[1-(2-furanyl)ethylamino]-5-sulfamoylbenzoic acid IUPAC Name: 4-butyl-2-[1-(furan-2-yl)ethylamino]-5-sulfamoylbenzoic acid Traditional Name: 4-butyl-2-[1-(2-furyl)ethylamino]-5-sulfamoyl-benzoic acid Formula: C17H22N2O5S MolecularWeight: 366.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C(=C1)NC(C)C2=CC=CO2)C(=O)O)S(=O)(=O)N

Isomeric SMILES

CCCCC1=C(C=C(C(=C1)NC(C)C2=CC=CO2)C(=O)O)S(=O)(=O)N

InChI

InChI=1S/C17H22N2O5S/c1-3-4-6-12-9-14(19-11(2)15-7-5-8-24-15)13(17(20)21)10-16(12)25(18,22)23/h5,7-11,19H,3-4,6H2,1-2H3,(H,20,21)(H2,18,22,23)