(1S)-2-piperazin-4-ium-1-yl-1-(4-propan-2-ylphenyl)ethanol

Systemtic Name: (1S)-2-piperazin-4-ium-1-yl-1-(4-propan-2-ylphenyl)ethanol Openeye Name: (1S)-1-(4-isopropylphenyl)-2-piperazin-4-ium-1-yl-ethanol CAS Name: (1S)-2-(1-piperazin-4-iumyl)-1-(4-propan-2-ylphenyl)ethanol IUPAC Name: (1S)-2-piperazin-4-ium-1-yl-1-(4-propan-2-ylphenyl)ethanol Traditional Name: (1S)-1-p-cumenyl-2-piperazin-4-ium-1-yl-ethanol Formula: C15H25N2O+ MolecularWeight: 249.3718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(CN2CC[NH2+]CC2)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)[C@@H](CN2CC[NH2+]CC2)O

InChI

InChI=1S/C15H24N2O/c1-12(2)13-3-5-14(6-4-13)15(18)11-17-9-7-16-8-10-17/h3-6,12,15-16,18H,7-11H2,1-2H3/p+1/t15-/m1/s1