methyl 2,4-bis(oxidanylidene)-3-(2-pyridin-2-ylethyl)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2,4-bis(oxidanylidene)-3-(2-pyridin-2-ylethyl)-1H-quinazoline-7-carboxylate Openeye Name: methyl 2,4-dioxo-3-[2-(2-pyridyl)ethyl]-1H-quinazoline-7-carboxylate CAS Name: 2,4-dioxo-3-[2-(2-pyridinyl)ethyl]-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2,4-dioxo-3-(2-pyridin-2-ylethyl)-1H-quinazoline-7-carboxylate Traditional Name: 2,4-diketo-3-[2-(2-pyridyl)ethyl]-1H-quinazoline-7-carboxylic acid methyl ester Formula: C17H15N3O4 MolecularWeight: 325.3187

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCC3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCC3=CC=CC=N3

InChI

InChI=1S/C17H15N3O4/c1-24-16(22)11-5-6-13-14(10-11)19-17(23)20(15(13)21)9-7-12-4-2-3-8-18-12/h2-6,8,10H,7,9H2,1H3,(H,19,23)