7-methyl-9-oxidanylidene-5-propyl-1-sulfamoyl-xanthene-2-carboxylic acid

Systemtic Name: 7-methyl-9-oxidanylidene-5-propyl-1-sulfamoyl-xanthene-2-carboxylic acid Openeye Name: 7-methyl-9-oxo-5-propyl-1-sulfamoyl-xanthene-2-carboxylic acid CAS Name: 7-methyl-9-oxo-5-propyl-1-sulfamoyl-2-xanthenecarboxylic acid IUPAC Name: 7-methyl-9-oxo-5-propyl-1-sulfamoylxanthene-2-carboxylic acid Traditional Name: 9-keto-7-methyl-5-propyl-1-sulfamoyl-xanthene-2-carboxylic acid Formula: C18H17NO6S MolecularWeight: 375.39568

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C2C(=CC(=C1)C)C(=O)C3=C(O2)C=CC(=C3S(=O)(=O)N)C(=O)O

Isomeric SMILES

CCCC1=C2C(=CC(=C1)C)C(=O)C3=C(O2)C=CC(=C3S(=O)(=O)N)C(=O)O

InChI

InChI=1S/C18H17NO6S/c1-3-4-10-7-9(2)8-12-15(20)14-13(25-16(10)12)6-5-11(18(21)22)17(14)26(19,23)24/h5-8H,3-4H2,1-2H3,(H,21,22)(H2,19,23,24)