2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-methyl-azanium

Systemtic Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxidanylidene-propan-2-yl]-methyl-azanium Openeye Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R)-2-[(4-fluorophenyl)methylamino]-1-methyl-2-oxo-ethyl]-methyl-ammonium CAS Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]-methylammonium IUPAC Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(2R)-1-[(4-fluorophenyl)methylamino]-1-oxopropan-2-yl]-methylazanium Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-ylmethyl-[(1R)-2-[(4-fluorobenzyl)amino]-2-keto-1-methyl-ethyl]-methyl-ammonium Formula: C20H24FN2O3+ MolecularWeight: 359.414563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=C(C=C1)F)[NH+](C)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=C(C=C1)F)[NH+](C)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H23FN2O3/c1-14(20(24)22-12-15-3-6-17(21)7-4-15)23(2)13-16-5-8-18-19(11-16)26-10-9-25-18/h3-8,11,14H,9-10,12-13H2,1-2H3,(H,22,24)/p+1/t14-/m1/s1