2-[(2S)-1-(2,2-dimethylpropyl)-4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(2,2-dimethylpropyl)-4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-(2,2-dimethylpropyl)-4-[(2-methoxy-1-naphthyl)methyl]piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(2,2-dimethylpropyl)-4-[(2-methoxy-1-naphthalenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-(2,2-dimethylpropyl)-4-[(2-methoxynaphthalen-1-yl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-4-[(2-methoxy-1-naphthyl)methyl]-1-neopentyl-piperazin-1-ium-2-yl]ethanol Formula: C23H35N2O2+ MolecularWeight: 371.5362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C[NH+]1CCN(CC1CCO)CC2=C(C=CC3=CC=CC=C32)OC

Isomeric SMILES

CC(C)(C)C[NH+]1CCN(C[C@@H]1CCO)CC2=C(C=CC3=CC=CC=C32)OC

InChI

InChI=1S/C23H34N2O2/c1-23(2,3)17-25-13-12-24(15-19(25)11-14-26)16-21-20-8-6-5-7-18(20)9-10-22(21)27-4/h5-10,19,26H,11-17H2,1-4H3/p+1/t19-/m0/s1