2-[4-[3-(6-methyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-(6-methyl-4-oxidanylidene-quinazolin-3-yl)-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-hydroxy-3-(6-methyl-4-oxo-quinazolin-3-yl)propoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-hydroxy-3-(6-methyl-4-oxo-3-quinazolinyl)propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-hydroxy-3-(6-methyl-4-oxoquinazolin-3-yl)propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-hydroxy-3-(4-keto-6-methyl-quinazolin-3-yl)propoxy]phenyl]acetonitrile Formula: C20H19N3O3 MolecularWeight: 349.38316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=CN(C2=O)CC(COC3=CC=C(C=C3)CC#N)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=CN(C2=O)CC(COC3=CC=C(C=C3)CC#N)O

InChI

InChI=1S/C20H19N3O3/c1-14-2-7-19-18(10-14)20(25)23(13-22-19)11-16(24)12-26-17-5-3-15(4-6-17)8-9-21/h2-7,10,13,16,24H,8,11-12H2,1H3