2-[[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl-methyl-amino]methyl]-4-methyl-phthalazin-1-one

Systemtic Name: 2-[[[3-[bis(fluoranyl)methoxy]-4-methoxy-phenyl]methyl-methyl-amino]methyl]-4-methyl-phthalazin-1-one Openeye Name: 2-[[[3-(difluoromethoxy)-4-methoxy-phenyl]methyl-methyl-amino]methyl]-4-methyl-phthalazin-1-one CAS Name: 2-[[[3-(difluoromethoxy)-4-methoxyphenyl]methyl-methylamino]methyl]-4-methyl-1-phthalazinone IUPAC Name: 2-[[[3-(difluoromethoxy)-4-methoxyphenyl]methyl-methylamino]methyl]-4-methylphthalazin-1-one Traditional Name: 2-[[[3-(difluoromethoxy)-4-methoxy-benzyl]-methyl-amino]methyl]-4-methyl-phthalazin-1-one Formula: C20H21F2N3O3 MolecularWeight: 389.395846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C2=CC=CC=C12)CN(C)CC3=CC(=C(C=C3)OC)OC(F)F

Isomeric SMILES

CC1=NN(C(=O)C2=CC=CC=C12)CN(C)CC3=CC(=C(C=C3)OC)OC(F)F

InChI

InChI=1S/C20H21F2N3O3/c1-13-15-6-4-5-7-16(15)19(26)25(23-13)12-24(2)11-14-8-9-17(27-3)18(10-14)28-20(21)22/h4-10,20H,11-12H2,1-3H3