2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)[N+]2(CCNCC2C(C)O)CC(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)[N+]2(CCNCC2C(C)O)CC(=O)N

InChI

InChI=1S/C16H25N3O2/c1-11-5-4-6-12(2)16(11)19(10-15(17)21)8-7-18-9-14(19)13(3)20/h4-6,13-14,18,20H,7-10H2,1-3H3,(H-,17,21)/p+1