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

Systemtic Name: [3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl 3-methoxynaphthalene-2-carboxylate Openeye Name: [3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl 3-methoxynaphthalene-2-carboxylate CAS Name: 3-methoxy-2-naphthalenecarboxylic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester IUPAC Name: [3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl 3-methoxynaphthalene-2-carboxylate Traditional Name: 3-methoxynaphthalene-2-carboxylic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester Formula: C23H17N3O4 MolecularWeight: 399.39878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=CC=CC=C2C=C1C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N

Isomeric SMILES

COC1=CC2=CC=CC=C2C=C1C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N

InChI

InChI=1S/C23H17N3O4/c1-29-20-13-16-7-3-2-6-15(16)12-18(20)23(28)30-14-21-25-19-9-5-4-8-17(19)22(27)26(21)11-10-24/h2-9,12-13H,11,14H2,1H3