2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one

Systemtic Name: 2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Openeye Name: 2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one CAS Name: 2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one IUPAC Name: 2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methylamino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Traditional Name: 2-[2-[[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl-methyl-amino]methyl]phenyl]-6-methyl-1H-pyrimidin-4-one Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)C2=CC=CC=C2CN(C)CC3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=CC(=O)N=C(N1)C2=CC=CC=C2CN(C)C[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C22H23N3O3/c1-15-11-21(26)24-22(23-15)18-8-4-3-7-16(18)12-25(2)13-17-14-27-19-9-5-6-10-20(19)28-17/h3-11,17H,12-14H2,1-2H3,(H,23,24,26)/t17-/m0/s1