2-[(2S)-1-(3-methylbutyl)-4-[(4-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol

Systemtic Name: 2-[(2S)-1-(3-methylbutyl)-4-[(4-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Openeye Name: 2-[(2S)-1-isopentyl-4-(p-tolylmethyl)piperazin-1-ium-2-yl]ethanol CAS Name: 2-[(2S)-1-(3-methylbutyl)-4-[(4-methylphenyl)methyl]-2-piperazin-1-iumyl]ethanol IUPAC Name: 2-[(2S)-1-(3-methylbutyl)-4-[(4-methylphenyl)methyl]piperazin-1-ium-2-yl]ethanol Traditional Name: 2-[(2S)-1-isoamyl-4-(4-methylbenzyl)piperazin-1-ium-2-yl]ethanol Formula: C19H33N2O+ MolecularWeight: 305.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC[NH+](C(C2)CCO)CCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2CC[NH+]([C@H](C2)CCO)CCC(C)C

InChI

InChI=1S/C19H32N2O/c1-16(2)8-10-21-12-11-20(15-19(21)9-13-22)14-18-6-4-17(3)5-7-18/h4-7,16,19,22H,8-15H2,1-3H3/p+1/t19-/m0/s1