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

Systemtic Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxidanylidene-piperazin-1-ium-2-yl]-N-methyl-N-(4-morpholin-4-ium-4-ylbutyl)ethanamide Openeye Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-piperazin-1-ium-2-yl]-N-methyl-N-(4-morpholin-4-ium-4-ylbutyl)acetamide CAS Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxo-2-piperazin-1-iumyl]-N-methyl-N-[4-(4-morpholin-4-iumyl)butyl]acetamide IUPAC Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-3-oxopiperazin-1-ium-2-yl]-N-methyl-N-(4-morpholin-4-ium-4-ylbutyl)acetamide Traditional Name: 2-[(2R)-1-(4-ethoxybenzyl)-3-keto-piperazin-1-ium-2-yl]-N-methyl-N-(4-morpholin-4-ium-4-ylbutyl)acetamide Formula: C24H40N4O4+2 MolecularWeight: 448.5988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)C2CC(=O)N(C)CCCC[NH+]3CCOCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCNC(=O)[C@H]2CC(=O)N(C)CCCC[NH+]3CCOCC3

InChI

InChI=1S/C24H38N4O4/c1-3-32-21-8-6-20(7-9-21)19-28-13-10-25-24(30)22(28)18-23(29)26(2)11-4-5-12-27-14-16-31-17-15-27/h6-9,22H,3-5,10-19H2,1-2H3,(H,25,30)/p+2/t22-/m1/s1