2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)-4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)-4-(phenylmethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-benzyl-1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)-4-(phenylmethyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-benzyl-1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-benzyl-1-(2,6-dimethylphenyl)-2-(1-hydroxyethyl)piperazin-1-ium-1-yl]acetamide Formula: C23H32N3O2+ MolecularWeight: 382.51908

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)[N+]2(CCN(CC2C(C)O)CC3=CC=CC=C3)CC(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)[N+]2(CCN(CC2C(C)O)CC3=CC=CC=C3)CC(=O)N

InChI

InChI=1S/C23H31N3O2/c1-17-8-7-9-18(2)23(17)26(16-22(24)28)13-12-25(15-21(26)19(3)27)14-20-10-5-4-6-11-20/h4-11,19,21,27H,12-16H2,1-3H3,(H-,24,28)/p+1