(2R)-1-[(2-methoxyphenyl)methoxy]-3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-2-ol

Systemtic Name: (2R)-1-[(2-methoxyphenyl)methoxy]-3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-2-ol Openeye Name: (2R)-1-[(2-methoxyphenyl)methoxy]-3-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]propan-2-ol CAS Name: (2R)-1-[(2-methoxyphenyl)methoxy]-3-[(2S)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-2-propanol IUPAC Name: (2R)-1-[(2-methoxyphenyl)methoxy]-3-[(2S)-4-methyl-2-phenylpiperazin-4-ium-1-yl]propan-2-ol Traditional Name: (2R)-1-[(2S)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-o-anisyloxy-propan-2-ol Formula: C22H31N2O3+ MolecularWeight: 371.49314

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CC(COCC3=CC=CC=C3OC)O

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)C[C@H](COCC3=CC=CC=C3OC)O

InChI

InChI=1S/C22H30N2O3/c1-23-12-13-24(21(15-23)18-8-4-3-5-9-18)14-20(25)17-27-16-19-10-6-7-11-22(19)26-2/h3-11,20-21,25H,12-17H2,1-2H3/p+1/t20-,21-/m1/s1