N-methyl-2-[(2R)-1-[(2-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-morpholin-4-ylethyl)ethanamide

Systemtic Name: N-methyl-2-[(2R)-1-[(2-methylphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-(2-morpholin-4-ylethyl)ethanamide Openeye Name: N-methyl-N-(2-morpholinoethyl)-2-[(2R)-1-(o-tolylmethyl)-3-oxo-piperazin-1-ium-2-yl]acetamide CAS Name: N-methyl-2-[(2R)-1-[(2-methylphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-[2-(4-morpholinyl)ethyl]acetamide IUPAC Name: N-methyl-2-[(2R)-1-[(2-methylphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-(2-morpholin-4-ylethyl)acetamide Traditional Name: 2-[(2R)-3-keto-1-(2-methylbenzyl)piperazin-1-ium-2-yl]-N-methyl-N-(2-morpholinoethyl)acetamide Formula: C21H33N4O3+ MolecularWeight: 389.51172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCNC(=O)C2CC(=O)N(C)CCN3CCOCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCNC(=O)[C@H]2CC(=O)N(C)CCN3CCOCC3

InChI

InChI=1S/C21H32N4O3/c1-17-5-3-4-6-18(17)16-25-8-7-22-21(27)19(25)15-20(26)23(2)9-10-24-11-13-28-14-12-24/h3-6,19H,7-16H2,1-2H3,(H,22,27)/p+1/t19-/m1/s1