diethyl 5-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[1,4-bis(oxidanylidene)-3H-phthalazin-2-yl]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-(1,4-dioxo-3H-phthalazin-2-yl)-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-(1,4-dioxo-3H-phthalazin-2-yl)-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(1,4-dioxo-3H-phthalazin-2-yl)-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-(1,4-diketo-3H-phthalazin-2-yl)-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C19H18N2O6S MolecularWeight: 402.42102

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N2C(=O)C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)N2C(=O)C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C19H18N2O6S/c1-4-26-18(24)13-10(3)14(19(25)27-5-2)28-17(13)21-16(23)12-9-7-6-8-11(12)15(22)20-21/h6-9H,4-5H2,1-3H3,(H,20,22)