4-[5-chloranyl-1-(6-chloranyl-4-phenyl-quinazolin-2-yl)indol-3-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[5-chloranyl-1-(6-chloranyl-4-phenyl-quinazolin-2-yl)indol-3-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[5-chloro-1-(6-chloro-4-phenyl-quinazolin-2-yl)indol-3-yl]-4-oxo-butanoic acid CAS Name: 4-[5-chloro-1-(6-chloro-4-phenyl-2-quinazolinyl)-3-indolyl]-4-oxobutanoic acid IUPAC Name: 4-[5-chloro-1-(6-chloro-4-phenylquinazolin-2-yl)indol-3-yl]-4-oxobutanoic acid Traditional Name: 4-[5-chloro-1-(6-chloro-4-phenyl-quinazolin-2-yl)indol-3-yl]-4-keto-butyric acid Formula: C26H17Cl2N3O3 MolecularWeight: 490.33748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N4C=C(C5=C4C=CC(=C5)Cl)C(=O)CCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC3=C2C=C(C=C3)Cl)N4C=C(C5=C4C=CC(=C5)Cl)C(=O)CCC(=O)O

InChI

InChI=1S/C26H17Cl2N3O3/c27-16-6-8-21-19(13-16)25(15-4-2-1-3-5-15)30-26(29-21)31-14-20(23(32)10-11-24(33)34)18-12-17(28)7-9-22(18)31/h1-9,12-14H,10-11H2,(H,33,34)