(E)-2-[6,8-bis(bromanyl)-3-methanoyl-4-oxidanylidene-quinazolin-2-yl]-3-(4-methoxyphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[6,8-bis(bromanyl)-3-methanoyl-4-oxidanylidene-quinazolin-2-yl]-3-(4-methoxyphenyl)prop-2-enenitrile Openeye Name: (E)-2-(6,8-dibromo-3-formyl-4-oxo-quinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile CAS Name: (E)-2-(6,8-dibromo-3-formyl-4-oxo-2-quinazolinyl)-3-(4-methoxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(6,8-dibromo-3-formyl-4-oxoquinazolin-2-yl)-3-(4-methoxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(6,8-dibromo-3-formyl-4-keto-quinazolin-2-yl)-3-(4-methoxyphenyl)acrylonitrile Formula: C19H11Br2N3O3 MolecularWeight: 489.11694

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=C(C#N)C2=NC3=C(C=C(C=C3C(=O)N2C=O)Br)Br

Isomeric SMILES

COC1=CC=C(C=C1)/C=C(\C#N)/C2=NC3=C(C=C(C=C3C(=O)N2C=O)Br)Br

InChI

InChI=1S/C19H11Br2N3O3/c1-27-14-4-2-11(3-5-14)6-12(9-22)18-23-17-15(19(26)24(18)10-25)7-13(20)8-16(17)21/h2-8,10H,1H3/b12-6+