(2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-piperazin-1-yl-ethanone

Systemtic Name: (2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-piperazin-1-yl-ethanone Openeye Name: (2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-piperazin-1-yl-ethanone CAS Name: (2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-(1-piperazinyl)ethanone IUPAC Name: (2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-piperazin-1-ylethanone Traditional Name: (2S)-2-(4-ethylphenyl)-2-[2-hydroxyethyl(methyl)amino]-1-piperazino-ethanone Formula: C17H27N3O2 MolecularWeight: 305.41518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C(=O)N2CCNCC2)N(C)CCO

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H](C(=O)N2CCNCC2)N(C)CCO

InChI

InChI=1S/C17H27N3O2/c1-3-14-4-6-15(7-5-14)16(19(2)12-13-21)17(22)20-10-8-18-9-11-20/h4-7,16,18,21H,3,8-13H2,1-2H3/t16-/m0/s1