(1S)-1-(2-methylphenyl)-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanol

Systemtic Name: (1S)-1-(2-methylphenyl)-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethanol Openeye Name: (1S)-2-(4-benzylpiperazin-4-ium-1-yl)-1-(o-tolyl)ethanol CAS Name: (1S)-1-(2-methylphenyl)-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethanol IUPAC Name: (1S)-2-(4-benzylpiperazin-4-ium-1-yl)-1-(2-methylphenyl)ethanol Traditional Name: (1S)-2-(4-benzylpiperazin-4-ium-1-yl)-1-(o-tolyl)ethanol Formula: C20H27N2O+ MolecularWeight: 311.44118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(CN2CC[NH+](CC2)CC3=CC=CC=C3)O

Isomeric SMILES

CC1=CC=CC=C1[C@@H](CN2CC[NH+](CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C20H26N2O/c1-17-7-5-6-10-19(17)20(23)16-22-13-11-21(12-14-22)15-18-8-3-2-4-9-18/h2-10,20,23H,11-16H2,1H3/p+1/t20-/m1/s1