ethyl 4-[6-bromanyl-2-[(E)-2-(3-hydroxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]benzoate

Systemtic Name: ethyl 4-[6-bromanyl-2-[(E)-2-(3-hydroxyphenyl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]benzoate Openeye Name: ethyl 4-[6-bromo-2-[(E)-2-(3-hydroxyphenyl)vinyl]-4-oxo-quinazolin-3-yl]benzoate CAS Name: 4-[6-bromo-2-[(E)-2-(3-hydroxyphenyl)ethenyl]-4-oxo-3-quinazolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[6-bromo-2-[(E)-2-(3-hydroxyphenyl)ethenyl]-4-oxoquinazolin-3-yl]benzoate Traditional Name: 4-[6-bromo-2-[(E)-2-(3-hydroxyphenyl)vinyl]-4-keto-quinazolin-3-yl]benzoic acid ethyl ester Formula: C25H19BrN2O4 MolecularWeight: 491.33336

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)Br)C=CC4=CC(=CC=C4)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)Br)/C=C/C4=CC(=CC=C4)O

InChI

InChI=1S/C25H19BrN2O4/c1-2-32-25(31)17-7-10-19(11-8-17)28-23(13-6-16-4-3-5-20(29)14-16)27-22-12-9-18(26)15-21(22)24(28)30/h3-15,29H,2H2,1H3/b13-6+