1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-(phenylmethyl)piperazin-1-ium

Systemtic Name: 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-(phenylmethyl)piperazin-1-ium Openeye Name: 1-benzyl-4-[(1R)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]piperazin-4-ium CAS Name: 1-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]-4-(phenylmethyl)piperazin-1-ium IUPAC Name: 1-benzyl-4-[(2R)-1-(3,4-dimethoxyphenyl)propan-2-yl]piperazin-4-ium Traditional Name: 1-benzyl-4-[(1R)-2-(3,4-dimethoxyphenyl)-1-methyl-ethyl]piperazin-4-ium Formula: C22H31N2O2+ MolecularWeight: 355.49374

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[C@H](CC1=CC(=C(C=C1)OC)OC)[NH+]2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N2O2/c1-18(15-20-9-10-21(25-2)22(16-20)26-3)24-13-11-23(12-14-24)17-19-7-5-4-6-8-19/h4-10,16,18H,11-15,17H2,1-3H3/p+1/t18-/m1/s1