methyl 2-[3-(hydroxymethyl)-4-oxidanylidene-phthalazin-1-yl]ethanoate

Systemtic Name: methyl 2-[3-(hydroxymethyl)-4-oxidanylidene-phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[3-(hydroxymethyl)-4-oxo-phthalazin-1-yl]acetate CAS Name: 2-[3-(hydroxymethyl)-4-oxo-1-phthalazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(hydroxymethyl)-4-oxophthalazin-1-yl]acetate Traditional Name: 2-(4-keto-3-methylol-phthalazin-1-yl)acetic acid methyl ester Formula: C12H12N2O4 MolecularWeight: 248.23468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CO

Isomeric SMILES

COC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CO

InChI

InChI=1S/C12H12N2O4/c1-18-11(16)6-10-8-4-2-3-5-9(8)12(17)14(7-15)13-10/h2-5,15H,6-7H2,1H3