(2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone

Systemtic Name: (2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone Openeye Name: (2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-yl-ethanone CAS Name: (2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methyl-1-piperidin-1-iumyl]-1-(1-piperazinyl)ethanone IUPAC Name: (2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazin-1-ylethanone Traditional Name: (2R)-2-(4-hydroxyphenyl)-2-[(2S)-2-methylpiperidin-1-ium-1-yl]-1-piperazino-ethanone Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1C(C2=CC=C(C=C2)O)C(=O)N3CCNCC3

Isomeric SMILES

C[C@H]1CCCC[NH+]1[C@H](C2=CC=C(C=C2)O)C(=O)N3CCNCC3

InChI

InChI=1S/C18H27N3O2/c1-14-4-2-3-11-21(14)17(15-5-7-16(22)8-6-15)18(23)20-12-9-19-10-13-20/h5-8,14,17,19,22H,2-4,9-13H2,1H3/p+1/t14-,17+/m0/s1