2-[[methyl-[2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[methyl-[2-oxidanyl-3-(2,3,6-trimethylphenoxy)propyl]amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-hydroxy-3-(2,3,6-trimethylphenoxy)propyl]-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C)OCC(CN(C)CC2=NC(=O)C3=CC=CC=C3N2)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1)C)OCC(CN(C)CC2=NC(=O)C3=CC=CC=C3N2)O)C

InChI

InChI=1S/C22H27N3O3/c1-14-9-10-15(2)21(16(14)3)28-13-17(26)11-25(4)12-20-23-19-8-6-5-7-18(19)22(27)24-20/h5-10,17,26H,11-13H2,1-4H3,(H,23,24,27)