[2-[2-(4-cyanophenyl)ethyl]quinazolin-7-yl] hydrogen carbonate

Systemtic Name: [2-[2-(4-cyanophenyl)ethyl]quinazolin-7-yl] hydrogen carbonate Openeye Name: [2-[2-(4-cyanophenyl)ethyl]quinazolin-7-yl] hydrogen carbonate CAS Name: carbonic acid [2-[2-(4-cyanophenyl)ethyl]-7-quinazolinyl] ester IUPAC Name: [2-[2-(4-cyanophenyl)ethyl]quinazolin-7-yl] hydrogen carbonate Traditional Name: carbonic acid [2-[2-(4-cyanophenyl)ethyl]quinazolin-7-yl] ester Formula: C18H13N3O3 MolecularWeight: 319.31412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCC2=NC=C3C=CC(=CC3=N2)OC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC=C1CCC2=NC=C3C=CC(=CC3=N2)OC(=O)O)C#N

InChI

InChI=1S/C18H13N3O3/c19-10-13-3-1-12(2-4-13)5-8-17-20-11-14-6-7-15(24-18(22)23)9-16(14)21-17/h1-4,6-7,9,11H,5,8H2,(H,22,23)