4-(4-oxidanylidene-3-propyl-7-sulfamoyl-chromen-2-yl)benzoic acid

Systemtic Name: 4-(4-oxidanylidene-3-propyl-7-sulfamoyl-chromen-2-yl)benzoic acid Openeye Name: 4-(4-oxo-3-propyl-7-sulfamoyl-chromen-2-yl)benzoic acid CAS Name: 4-(4-oxo-3-propyl-7-sulfamoyl-1-benzopyran-2-yl)benzoic acid IUPAC Name: 4-(4-oxo-3-propyl-7-sulfamoylchromen-2-yl)benzoic acid Traditional Name: 4-(4-keto-3-propyl-7-sulfamoyl-chromen-2-yl)benzoic acid Formula: C19H17NO6S MolecularWeight: 387.40638

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC2=C(C1=O)C=CC(=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCC1=C(OC2=C(C1=O)C=CC(=C2)S(=O)(=O)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H17NO6S/c1-2-3-15-17(21)14-9-8-13(27(20,24)25)10-16(14)26-18(15)11-4-6-12(7-5-11)19(22)23/h4-10H,2-3H2,1H3,(H,22,23)(H2,20,24,25)