(E)-2-(7-chloranyl-4-oxidanylidene-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(7-chloranyl-4-oxidanylidene-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(7-chloro-4-oxo-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-(7-chloro-4-oxo-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(7-chloro-4-oxo-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(7-chloro-4-keto-4aH-quinazolin-2-yl)-3-(4-methoxyphenyl)acrylonitrile Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C2=NC(=O)C3C=CC(=CC3=N2)Cl

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3C=CC(=CC3=N2)Cl

InChI

InChI=1S/C18H12ClN3O2/c1-24-14-5-2-11(3-6-14)8-12(10-20)17-21-16-9-13(19)4-7-15(16)18(23)22-17/h2-9,15H,1H3/b12-8+