3-[1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl]-4-oxidanylidene-phthalazine-1-carboxylic acid

Systemtic Name: 3-[1-[(4-fluorophenyl)amino]-1-oxidanylidene-butan-2-yl]-4-oxidanylidene-phthalazine-1-carboxylic acid Openeye Name: 3-[1-[(4-fluorophenyl)carbamoyl]propyl]-4-oxo-phthalazine-1-carboxylic acid CAS Name: 3-[1-(4-fluoroanilino)-1-oxobutan-2-yl]-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-[1-(4-fluoroanilino)-1-oxobutan-2-yl]-4-oxophthalazine-1-carboxylic acid Traditional Name: 3-[1-[(4-fluorophenyl)carbamoyl]propyl]-4-keto-phthalazine-1-carboxylic acid Formula: C19H16FN3O4 MolecularWeight: 369.346443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)F)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)F)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)O

InChI

InChI=1S/C19H16FN3O4/c1-2-15(17(24)21-12-9-7-11(20)8-10-12)23-18(25)14-6-4-3-5-13(14)16(22-23)19(26)27/h3-10,15H,2H2,1H3,(H,21,24)(H,26,27)