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

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

Systemtic Name:[3-(cyanomethyl)-4-oxidanylidene-quinazolin-2-yl]methyl quinoline-2-carboxylate
Openeye Name:[3-(cyanomethyl)-4-oxo-quinazolin-2-yl]methyl quinoline-2-carboxylate
CAS Name:2-quinolinecarboxylic acid [3-(cyanomethyl)-4-oxo-2-quinazolinyl]methyl ester
IUPAC Name:[3-(cyanomethyl)-4-oxoquinazolin-2-yl]methyl quinoline-2-carboxylate
Traditional Name:quinaldic acid [3-(cyanomethyl)-4-keto-quinazolin-2-yl]methyl ester
Formula: C21H14N4O3
MolecularWeight: 370.36086
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N


Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)C(=O)OCC3=NC4=CC=CC=C4C(=O)N3CC#N


InChI

InChI=1S/C21H14N4O3/c22-11-12-25-19(24-17-8-4-2-6-15(17)20(25)26)13-28-21(27)18-10-9-14-5-1-3-7-16(14)23-18/h1-10H,12-13H2


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