ethyl 1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazine-2-carboxylate

Systemtic Name: ethyl 1-oxidanylidene-4-(pyridin-4-ylmethyl)phthalazine-2-carboxylate Openeye Name: ethyl 1-oxo-4-(4-pyridylmethyl)phthalazine-2-carboxylate CAS Name: 1-oxo-4-(pyridin-4-ylmethyl)-2-phthalazinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-oxo-4-(pyridin-4-ylmethyl)phthalazine-2-carboxylate Traditional Name: 1-keto-4-(4-pyridylmethyl)phthalazine-2-carboxylic acid ethyl ester Formula: C17H15N3O3 MolecularWeight: 309.3193

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

Isomeric SMILES

CCOC(=O)N1C(=O)C2=CC=CC=C2C(=N1)CC3=CC=NC=C3

InChI

InChI=1S/C17H15N3O3/c1-2-23-17(22)20-16(21)14-6-4-3-5-13(14)15(19-20)11-12-7-9-18-10-8-12/h3-10H,2,11H2,1H3