7-chloranyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazoline-2-carbonitrile

Systemtic Name: 7-chloranyl-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxidanylidene-quinazoline-2-carbonitrile Openeye Name: 7-chloro-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-quinazoline-2-carbonitrile CAS Name: 7-chloro-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-quinazolinecarbonitrile IUPAC Name: 7-chloro-3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxoquinazoline-2-carbonitrile Traditional Name: 7-chloro-3-homoveratryl-4-keto-quinazoline-2-carbonitrile Formula: C19H16ClN3O3 MolecularWeight: 369.80164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=NC3=C(C2=O)C=CC(=C3)Cl)C#N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=NC3=C(C2=O)C=CC(=C3)Cl)C#N)OC

InChI

InChI=1S/C19H16ClN3O3/c1-25-16-6-3-12(9-17(16)26-2)7-8-23-18(11-21)22-15-10-13(20)4-5-14(15)19(23)24/h3-6,9-10H,7-8H2,1-2H3