2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]oxyethanenitrile

Systemtic Name: 2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxidanylidene-quinazolin-6-yl]oxyethanenitrile Openeye Name: 2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxo-quinazolin-6-yl]oxyacetonitrile CAS Name: 2-[[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxo-6-quinazolinyl]oxy]acetonitrile IUPAC Name: 2-[3-(1,3-benzodioxol-5-yl)-2-methyl-4-oxoquinazolin-6-yl]oxyacetonitrile Traditional Name: 2-[3-(1,3-benzodioxol-5-yl)-4-keto-2-methyl-quinazolin-6-yl]oxyacetonitrile Formula: C18H13N3O4 MolecularWeight: 335.31352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)OCC#N)C(=O)N1C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)OCC#N)C(=O)N1C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H13N3O4/c1-11-20-15-4-3-13(23-7-6-19)9-14(15)18(22)21(11)12-2-5-16-17(8-12)25-10-24-16/h2-5,8-9H,7,10H2,1H3