N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[2-(2-methoxyphenyl)ethyl]-2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-[4-(2-keto-2-morpholino-ethyl)piperazin-1-ium-1-yl]-N-[2-(2-methoxyphenyl)ethyl]acetamide Formula: C21H33N4O4+ MolecularWeight: 405.51112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CCNC(=O)C[NH+]2CCN(CC2)CC(=O)N3CCOCC3

Isomeric SMILES

COC1=CC=CC=C1CCNC(=O)C[NH+]2CCN(CC2)CC(=O)N3CCOCC3

InChI

InChI=1S/C21H32N4O4/c1-28-19-5-3-2-4-18(19)6-7-22-20(26)16-23-8-10-24(11-9-23)17-21(27)25-12-14-29-15-13-25/h2-5H,6-17H2,1H3,(H,22,26)/p+1