3-(2-diphenylphosphanyl-4,6-dimethyl-phenyl)quinazolin-4-one

Systemtic Name: 3-(2-diphenylphosphanyl-4,6-dimethyl-phenyl)quinazolin-4-one Openeye Name: 3-(2-diphenylphosphanyl-4,6-dimethyl-phenyl)quinazolin-4-one CAS Name: 3-(2-diphenylphosphino-4,6-dimethylphenyl)-4-quinazolinone IUPAC Name: 3-(2-diphenylphosphanyl-4,6-dimethylphenyl)quinazolin-4-one Traditional Name: 3-(2-diphenylphosphino-4,6-dimethyl-phenyl)quinazolin-4-one Formula: C28H23N2OP MolecularWeight: 434.468781

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3)N4C=NC5=CC=CC=C5C4=O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)P(C2=CC=CC=C2)C3=CC=CC=C3)N4C=NC5=CC=CC=C5C4=O)C

InChI

InChI=1S/C28H23N2OP/c1-20-17-21(2)27(30-19-29-25-16-10-9-15-24(25)28(30)31)26(18-20)32(22-11-5-3-6-12-22)23-13-7-4-8-14-23/h3-19H,1-2H3