(8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate

Systemtic Name: (8-methyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 2-[1,3-bis(oxidanylidene)-4H-isoquinolin-2-yl]ethanoate Openeye Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate CAS Name: 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetic acid (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (8-methyl-4-oxo-1H-quinazolin-2-yl)methyl 2-(1,3-dioxo-4H-isoquinolin-2-yl)acetate Traditional Name: 2-(1,3-diketo-4H-isoquinolin-2-yl)acetic acid (4-keto-8-methyl-1H-quinazolin-2-yl)methyl ester Formula: C21H17N3O5 MolecularWeight: 391.37678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC=CC2=C1NC(=NC2=O)COC(=O)CN3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C21H17N3O5/c1-12-5-4-8-15-19(12)22-16(23-20(15)27)11-29-18(26)10-24-17(25)9-13-6-2-3-7-14(13)21(24)28/h2-8H,9-11H2,1H3,(H,22,23,27)