2-[[4-[2,3-bis(oxidanyl)propoxy]phenyl]methyl-methyl-amino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one

Systemtic Name: 2-[[4-[2,3-bis(oxidanyl)propoxy]phenyl]methyl-methyl-amino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one Openeye Name: 2-[[4-(2,3-dihydroxypropoxy)phenyl]methyl-methyl-amino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one CAS Name: 2-[[4-(2,3-dihydroxypropoxy)phenyl]methyl-methylamino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one IUPAC Name: 2-[[4-(2,3-dihydroxypropoxy)phenyl]methyl-methylamino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one Traditional Name: 2-[(4-glyceryloxybenzyl)-methyl-amino]-6,7-dimethoxy-5-methyl-1H-quinazolin-4-one Formula: C22H27N3O6 MolecularWeight: 429.46628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1OC)OC)NC(=NC2=O)N(C)CC3=CC=C(C=C3)OCC(CO)O

Isomeric SMILES

CC1=C2C(=CC(=C1OC)OC)NC(=NC2=O)N(C)CC3=CC=C(C=C3)OCC(CO)O

InChI

InChI=1S/C22H27N3O6/c1-13-19-17(9-18(29-3)20(13)30-4)23-22(24-21(19)28)25(2)10-14-5-7-16(8-6-14)31-12-15(27)11-26/h5-9,15,26-27H,10-12H2,1-4H3,(H,23,24,28)