2-[3-azanyl-4-oxidanylidene-1-(2-oxidanylideneethyl)-5-phenyl-2H-phthalazin-1-yl]ethanoic acid

Systemtic Name: 2-[3-azanyl-4-oxidanylidene-1-(2-oxidanylideneethyl)-5-phenyl-2H-phthalazin-1-yl]ethanoic acid Openeye Name: 2-[3-amino-4-oxo-1-(2-oxoethyl)-5-phenyl-2H-phthalazin-1-yl]acetic acid CAS Name: 2-[3-amino-4-oxo-1-(2-oxoethyl)-5-phenyl-2H-phthalazin-1-yl]acetic acid IUPAC Name: 2-[3-amino-4-oxo-1-(2-oxoethyl)-5-phenyl-2H-phthalazin-1-yl]acetic acid Traditional Name: 2-[3-amino-4-keto-1-(2-ketoethyl)-5-phenyl-2H-phthalazin-1-yl]acetic acid Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=CC=C2)C(NN(C3=O)N)(CC=O)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=CC=C2)C(NN(C3=O)N)(CC=O)CC(=O)O

InChI

InChI=1S/C18H17N3O4/c19-21-17(25)16-13(12-5-2-1-3-6-12)7-4-8-14(16)18(20-21,9-10-22)11-15(23)24/h1-8,10,20H,9,11,19H2,(H,23,24)