2-(4-sulfamoylphenoxy)ethyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: 2-(4-sulfamoylphenoxy)ethyl 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: 2-(4-sulfamoylphenoxy)ethyl 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid 2-(4-sulfamoylphenoxy)ethyl ester IUPAC Name: 2-(4-sulfamoylphenoxy)ethyl 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid 2-(4-sulfamoylphenoxy)ethyl ester Formula: C20H21N3O6S MolecularWeight: 431.46224

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCOC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C20H21N3O6S/c1-2-11-23-19(24)17-6-4-3-5-16(17)18(22-23)20(25)29-13-12-28-14-7-9-15(10-8-14)30(21,26)27/h3-10H,2,11-13H2,1H3,(H2,21,26,27)