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

Systemtic Name: methyl 2-[3-methyl-2-(4-nitrophenyl)-4-oxidanylidene-1H-phthalazin-1-yl]ethanoate Openeye Name: methyl 2-[3-methyl-2-(4-nitrophenyl)-4-oxo-1H-phthalazin-1-yl]acetate CAS Name: 2-[3-methyl-2-(4-nitrophenyl)-4-oxo-1H-phthalazin-1-yl]acetic acid methyl ester IUPAC Name: methyl 2-[3-methyl-2-(4-nitrophenyl)-4-oxo-1H-phthalazin-1-yl]acetate Traditional Name: 2-[4-keto-3-methyl-2-(4-nitrophenyl)-1H-phthalazin-1-yl]acetic acid methyl ester Formula: C18H17N3O5 MolecularWeight: 355.34468

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(N1C3=CC=C(C=C3)[N+](=O)[O-])CC(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(N1C3=CC=C(C=C3)[N+](=O)[O-])CC(=O)OC

InChI

InChI=1S/C18H17N3O5/c1-19-18(23)15-6-4-3-5-14(15)16(11-17(22)26-2)20(19)12-7-9-13(10-8-12)21(24)25/h3-10,16H,11H2,1-2H3