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

Systemtic Name: N-[(2-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-[(2-methoxyphenyl)methyl]acetamide CAS Name: N-[(2-methoxyphenyl)methyl]-2-[(2R)-1-(3-methylbutyl)-3-oxo-2-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2-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-o-anisyl-acetamide Formula: C19H30N3O3+ MolecularWeight: 348.4598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC[NH+]1CCNC(=O)C1CC(=O)NCC2=CC=CC=C2OC

Isomeric SMILES

CC(C)CC[NH+]1CCNC(=O)[C@H]1CC(=O)NCC2=CC=CC=C2OC

InChI

InChI=1S/C19H29N3O3/c1-14(2)8-10-22-11-9-20-19(24)16(22)12-18(23)21-13-15-6-4-5-7-17(15)25-3/h4-7,14,16H,8-13H2,1-3H3,(H,20,24)(H,21,23)/p+1/t16-/m1/s1