(phenylmethyl) 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoate

Systemtic Name: (phenylmethyl) 3-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]propanoate Openeye Name: benzyl 3-(1,4-dioxo-3H-phthalazin-2-yl)propanoate CAS Name: 3-(1,4-dioxo-3H-phthalazin-2-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 3-(1,4-dioxo-3H-phthalazin-2-yl)propanoate Traditional Name: 3-(1,4-diketo-3H-phthalazin-2-yl)propionic acid benzyl ester Formula: C18H16N2O4 MolecularWeight: 324.33064

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CCN2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C18H16N2O4/c21-16(24-12-13-6-2-1-3-7-13)10-11-20-18(23)15-9-5-4-8-14(15)17(22)19-20/h1-9H,10-12H2,(H,19,22)