(E)-3-(4-butoxy-3-methoxy-phenyl)-2-(7-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-(7-methyl-4-oxidanylidene-1H-quinazolin-2-yl)prop-2-enenitrile Openeye Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-(7-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile CAS Name: (E)-3-(4-butoxy-3-methoxyphenyl)-2-(7-methyl-4-oxo-1H-quinazolin-2-yl)-2-propenenitrile IUPAC Name: (E)-3-(4-butoxy-3-methoxyphenyl)-2-(7-methyl-4-oxo-1H-quinazolin-2-yl)prop-2-enenitrile Traditional Name: (E)-3-(4-butoxy-3-methoxy-phenyl)-2-(4-keto-7-methyl-1H-quinazolin-2-yl)acrylonitrile Formula: C23H23N3O3 MolecularWeight: 389.44702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=C(C#N)C2=NC(=O)C3=C(N2)C=C(C=C3)C)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C(\C#N)/C2=NC(=O)C3=C(N2)C=C(C=C3)C)OC

InChI

InChI=1S/C23H23N3O3/c1-4-5-10-29-20-9-7-16(13-21(20)28-3)12-17(14-24)22-25-19-11-15(2)6-8-18(19)23(27)26-22/h6-9,11-13H,4-5,10H2,1-3H3,(H,25,26,27)/b17-12+