2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxy-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxy-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxy-quinazolin-4-one CAS Name: 2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxy-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxyquinazolin-4-one Traditional Name: 3-benzyl-2-[4-(diethoxyphosphorylmethyl)phenyl]-6,7-dimethoxy-quinazolin-4-one Formula: C28H31N2O6P MolecularWeight: 522.529301

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CC=C4)OC)OC)OCC

Isomeric SMILES

CCOP(=O)(CC1=CC=C(C=C1)C2=NC3=CC(=C(C=C3C(=O)N2CC4=CC=CC=C4)OC)OC)OCC

InChI

InChI=1S/C28H31N2O6P/c1-5-35-37(32,36-6-2)19-21-12-14-22(15-13-21)27-29-24-17-26(34-4)25(33-3)16-23(24)28(31)30(27)18-20-10-8-7-9-11-20/h7-17H,5-6,18-19H2,1-4H3