(E)-2-(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(6-chloro-4-oxo-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(6-chloro-4-keto-1H-quinazolin-2-yl)-3-(4-ethoxy-3-methoxy-phenyl)acrylonitrile Formula: C20H16ClN3O3 MolecularWeight: 381.81234

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C=C(C#N)C2=NC(=O)C3=C(N2)C=CC(=C3)Cl)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=CC(=C3)Cl)OC

InChI

InChI=1S/C20H16ClN3O3/c1-3-27-17-7-4-12(9-18(17)26-2)8-13(11-22)19-23-16-6-5-14(21)10-15(16)20(25)24-19/h4-10H,3H2,1-2H3,(H,23,24,25)/b13-8+