(2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate

Systemtic Name: (2-chloranyl-7,8-dimethyl-quinolin-3-yl)methyl 2-(4-aminocarbonyl-1-oxidanylidene-phthalazin-2-yl)ethanoate Openeye Name: (2-chloro-7,8-dimethyl-3-quinolyl)methyl 2-(4-carbamoyl-1-oxo-phthalazin-2-yl)acetate CAS Name: 2-(4-carbamoyl-1-oxo-2-phthalazinyl)acetic acid (2-chloro-7,8-dimethyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7,8-dimethylquinolin-3-yl)methyl 2-(4-carbamoyl-1-oxophthalazin-2-yl)acetate Traditional Name: 2-(4-carbamoyl-1-keto-phthalazin-2-yl)acetic acid (2-chloro-7,8-dimethyl-3-quinolyl)methyl ester Formula: C23H19ClN4O4 MolecularWeight: 450.87436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)COC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)N)Cl)C

InChI

InChI=1S/C23H19ClN4O4/c1-12-7-8-14-9-15(21(24)26-19(14)13(12)2)11-32-18(29)10-28-23(31)17-6-4-3-5-16(17)20(27-28)22(25)30/h3-9H,10-11H2,1-2H3,(H2,25,30)