3-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-8-iodanyl-2-phenyl-quinazolin-4-one

Systemtic Name: 3-[2-[3,4-bis(oxidanyl)phenyl]ethyl]-8-iodanyl-2-phenyl-quinazolin-4-one Openeye Name: 3-[2-(3,4-dihydroxyphenyl)ethyl]-8-iodo-2-phenyl-quinazolin-4-one CAS Name: 3-[2-(3,4-dihydroxyphenyl)ethyl]-8-iodo-2-phenyl-4-quinazolinone IUPAC Name: 3-[2-(3,4-dihydroxyphenyl)ethyl]-8-iodo-2-phenylquinazolin-4-one Traditional Name: 3-[2-(3,4-dihydroxyphenyl)ethyl]-8-iodo-2-phenyl-quinazolin-4-one Formula: C22H17IN2O3 MolecularWeight: 484.28645

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C=CC=C3I)C(=O)N2CCC4=CC(=C(C=C4)O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C=CC=C3I)C(=O)N2CCC4=CC(=C(C=C4)O)O

InChI

InChI=1S/C22H17IN2O3/c23-17-8-4-7-16-20(17)24-21(15-5-2-1-3-6-15)25(22(16)28)12-11-14-9-10-18(26)19(27)13-14/h1-10,13,26-27H,11-12H2