N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-(3-methylbutyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-(3-methylbutyl)-3-oxidanylidene-piperazin-1-ium-2-yl]ethanamide Openeye Name: 2-[(2R)-1-isopentyl-3-oxo-piperazin-1-ium-2-yl]-N-[(4-methoxyphenyl)methyl]acetamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-(3-methylbutyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(2R)-1-(3-methylbutyl)-3-oxopiperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-1-isoamyl-3-keto-piperazin-1-ium-2-yl]-N-p-anisyl-acetamide Formula: C19H30N3O3+ MolecularWeight: 348.4598

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+]1CCNC(=O)C1CC(=O)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CC(C)CC[NH+]1CCNC(=O)[C@H]1CC(=O)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C19H29N3O3/c1-14(2)8-10-22-11-9-20-19(24)17(22)12-18(23)21-13-15-4-6-16(25-3)7-5-15/h4-7,14,17H,8-13H2,1-3H3,(H,20,24)(H,21,23)/p+1/t17-/m1/s1