[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl naphthalene-2-carboxylate

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl naphthalene-2-carboxylate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl naphthalene-2-carboxylate CAS Name: 2-naphthalenecarboxylic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl naphthalene-2-carboxylate Traditional Name: naphthalene-2-carboxylic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C22H15N3O3 MolecularWeight: 369.3728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C22H15N3O3/c23-11-12-25-20(24-19-8-4-3-7-18(19)21(25)26)14-28-22(27)17-10-9-15-5-1-2-6-16(15)13-17/h1-10,13H,12,14H2