(3-fluoranyl-4-methoxy-phenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxo-ethyl]-methyl-ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)-1-piperazinyl]-2-oxoethyl]-methylammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-[2-[4-(4-hydroxyphenyl)piperazin-1-yl]-2-oxoethyl]-methylazanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[2-[4-(4-hydroxyphenyl)piperazino]-2-keto-ethyl]-methyl-ammonium Formula: C21H27FN3O3+ MolecularWeight: 388.455783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)F)CC(=O)N2CCN(CC2)C3=CC=C(C=C3)O

InChI

InChI=1S/C21H26FN3O3/c1-23(14-16-3-8-20(28-2)19(22)13-16)15-21(27)25-11-9-24(10-12-25)17-4-6-18(26)7-5-17/h3-8,13,26H,9-12,14-15H2,1-2H3/p+1