4-oxidanylidene-3-(1-oxidanylidene-1-phenylazanyl-butan-2-yl)phthalazine-1-carboxylic acid

Systemtic Name: 4-oxidanylidene-3-(1-oxidanylidene-1-phenylazanyl-butan-2-yl)phthalazine-1-carboxylic acid Openeye Name: 4-oxo-3-[1-(phenylcarbamoyl)propyl]phthalazine-1-carboxylic acid CAS Name: 3-(1-anilino-1-oxobutan-2-yl)-4-oxo-1-phthalazinecarboxylic acid IUPAC Name: 3-(1-anilino-1-oxobutan-2-yl)-4-oxophthalazine-1-carboxylic acid Traditional Name: 4-keto-3-[1-(phenylcarbamoyl)propyl]phthalazine-1-carboxylic acid Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N3O4/c1-2-15(17(23)20-12-8-4-3-5-9-12)22-18(24)14-11-7-6-10-13(14)16(21-22)19(25)26/h3-11,15H,2H2,1H3,(H,20,23)(H,25,26)