(3R)-4-[(2-methylphenyl)methyl]-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-2-one

Systemtic Name: (3R)-4-[(2-methylphenyl)methyl]-3-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-4-ium-2-one Openeye Name: (3R)-3-(2-morpholino-2-oxo-ethyl)-4-(o-tolylmethyl)piperazin-4-ium-2-one CAS Name: (3R)-4-[(2-methylphenyl)methyl]-3-[2-(4-morpholinyl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-4-[(2-methylphenyl)methyl]-3-(2-morpholin-4-yl-2-oxoethyl)piperazin-4-ium-2-one Traditional Name: (3R)-3-(2-keto-2-morpholino-ethyl)-4-(2-methylbenzyl)piperazin-4-ium-2-one Formula: C18H26N3O3+ MolecularWeight: 332.41734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)N3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)N3CCOCC3

InChI

InChI=1S/C18H25N3O3/c1-14-4-2-3-5-15(14)13-21-7-6-19-18(23)16(21)12-17(22)20-8-10-24-11-9-20/h2-5,16H,6-13H2,1H3,(H,19,23)/p+1/t16-/m1/s1