4-[2-[(E)-2-(7-chloranyl-1,3-benzodioxol-5-yl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]benzoate

Systemtic Name: 4-[2-[(E)-2-(7-chloranyl-1,3-benzodioxol-5-yl)ethenyl]-4-oxidanylidene-quinazolin-3-yl]benzoate Openeye Name: 4-[2-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)vinyl]-4-oxo-quinazolin-3-yl]benzoate CAS Name: 4-[2-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)ethenyl]-4-oxo-3-quinazolinyl]benzoate IUPAC Name: 4-[2-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)ethenyl]-4-oxoquinazolin-3-yl]benzoate Traditional Name: 4-[2-[(E)-2-(7-chloro-1,3-benzodioxol-5-yl)vinyl]-4-keto-quinazolin-3-yl]benzoate Formula: C24H14ClN2O5- MolecularWeight: 445.83136

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=CC(=C2)C=CC3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C(=O)[O-])Cl

Isomeric SMILES

C1OC2=C(O1)C(=CC(=C2)/C=C/C3=NC4=CC=CC=C4C(=O)N3C5=CC=C(C=C5)C(=O)[O-])Cl

InChI

InChI=1S/C24H15ClN2O5/c25-18-11-14(12-20-22(18)32-13-31-20)5-10-21-26-19-4-2-1-3-17(19)23(28)27(21)16-8-6-15(7-9-16)24(29)30/h1-12H,13H2,(H,29,30)/p-1/b10-5+