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

Systemtic Name: ethyl 4-[2-[(E)-2-(2-chlorophenyl)ethenyl]-6-iodanyl-4-oxidanylidene-quinazolin-3-yl]benzoate Openeye Name: ethyl 4-[2-[(E)-2-(2-chlorophenyl)vinyl]-6-iodo-4-oxo-quinazolin-3-yl]benzoate CAS Name: 4-[2-[(E)-2-(2-chlorophenyl)ethenyl]-6-iodo-4-oxo-3-quinazolinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-[(E)-2-(2-chlorophenyl)ethenyl]-6-iodo-4-oxoquinazolin-3-yl]benzoate Traditional Name: 4-[2-[(E)-2-(2-chlorophenyl)vinyl]-6-iodo-4-keto-quinazolin-3-yl]benzoic acid ethyl ester Formula: C25H18ClIN2O3 MolecularWeight: 556.77949

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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)I)C=CC4=CC=CC=C4Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=NC3=C(C2=O)C=C(C=C3)I)/C=C/C4=CC=CC=C4Cl

InChI

InChI=1S/C25H18ClIN2O3/c1-2-32-25(31)17-7-11-19(12-8-17)29-23(14-9-16-5-3-4-6-21(16)26)28-22-13-10-18(27)15-20(22)24(29)30/h3-15H,2H2,1H3/b14-9+