[(2S)-2-(3-hydroxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium

Systemtic Name: [(2S)-2-(3-hydroxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Openeye Name: [(2S)-2-(3-hydroxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium CAS Name: [(2S)-2-(3-hydroxyphenyl)-2-(4-methyl-1-piperazin-4-iumyl)ethyl]ammonium IUPAC Name: [(2S)-2-(3-hydroxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]azanium Traditional Name: [(2S)-2-(3-hydroxyphenyl)-2-(4-methylpiperazin-4-ium-1-yl)ethyl]ammonium Formula: C13H23N3O+2 MolecularWeight: 237.34122

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(C[NH3+])C2=CC(=CC=C2)O

Isomeric SMILES

C[NH+]1CCN(CC1)[C@H](C[NH3+])C2=CC(=CC=C2)O

InChI

InChI=1S/C13H21N3O/c1-15-5-7-16(8-6-15)13(10-14)11-3-2-4-12(17)9-11/h2-4,9,13,17H,5-8,10,14H2,1H3/p+2/t13-/m1/s1