4-oxidanylidene-3-[2-oxidanylidene-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]phthalazine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-[2-oxidanylidene-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]phthalazine-1-carboxylic acid Openeye Name: 4-oxo-3-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]phthalazine-1-carboxylic acid CAS Name: 4-oxo-3-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]-1-phthalazinecarboxylic acid IUPAC Name: 4-oxo-3-[2-oxo-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]phthalazine-1-carboxylic acid Traditional Name: 4-keto-3-[2-keto-2-[1-(4-sulfamoylphenyl)ethylamino]ethyl]phthalazine-1-carboxylic acid Formula: C19H18N4O6S MolecularWeight: 430.43442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)N)NC(=O)CN2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C19H18N4O6S/c1-11(12-6-8-13(9-7-12)30(20,28)29)21-16(24)10-23-18(25)15-5-3-2-4-14(15)17(22-23)19(26)27/h2-9,11H,10H2,1H3,(H,21,24)(H,26,27)(H2,20,28,29)