(3R)-3-(2-methoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-propan-1-one

Systemtic Name: (3R)-3-(2-methoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-propan-1-one Openeye Name: (3R)-3-(2-methoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-propan-1-one CAS Name: (3R)-3-(2-methoxyphenyl)-1-(4-methyl-1-piperazin-4-iumyl)-3-phenyl-1-propanone IUPAC Name: (3R)-3-(2-methoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenylpropan-1-one Traditional Name: (3R)-3-(2-methoxyphenyl)-1-(4-methylpiperazin-4-ium-1-yl)-3-phenyl-propan-1-one Formula: C21H27N2O2+ MolecularWeight: 339.45128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CC(C2=CC=CC=C2)C3=CC=CC=C3OC

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C[C@H](C2=CC=CC=C2)C3=CC=CC=C3OC

InChI

InChI=1S/C21H26N2O2/c1-22-12-14-23(15-13-22)21(24)16-19(17-8-4-3-5-9-17)18-10-6-7-11-20(18)25-2/h3-11,19H,12-16H2,1-2H3/p+1/t19-/m1/s1