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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2O2/c1-22-12-14-23(15-13-22)21(24)16-20(17-6-4-3-5-7-17)18-8-10-19(25-2)11-9-18/h3-11,20H,12-16H2,1-2H3/p+1/t20-/m1/s1