2-[(2S)-4-[(4-phenylphenyl)methyl]-1-propan-2-yl-piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-4-[(4-phenylphenyl)methyl]-1-propan-2-yl-piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-isopropyl-4-[(4-phenylphenyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-4-[(4-phenylphenyl)methyl]-1-propan-2-yl-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-4-[(4-phenylphenyl)methyl]-1-propan-2-ylpiperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isopropyl-4-(4-phenylbenzyl)piperazin-1-ium-2-yl]ethanol Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1CCO)CC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCN(C[C@@H]1CCO)CC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H30N2O/c1-18(2)24-14-13-23(17-22(24)12-15-25)16-19-8-10-21(11-9-19)20-6-4-3-5-7-20/h3-11,18,22,25H,12-17H2,1-2H3/p+1/t22-/m0/s1