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

Systemtic Name: 2-[4-(2-morpholin-4-yl-2-oxidanylidene-ethyl)piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)ethanamide Openeye Name: 2-[4-(2-morpholino-2-oxo-ethyl)piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide CAS Name: 2-[4-[2-(4-morpholinyl)-2-oxoethyl]-1-piperazin-1-iumyl]-N-[4-(1-pyrrolidinyl)phenyl]acetamide IUPAC Name: 2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-ium-1-yl]-N-(4-pyrrolidin-1-ylphenyl)acetamide Traditional Name: 2-[4-(2-keto-2-morpholino-ethyl)piperazin-1-ium-1-yl]-N-(4-pyrrolidinophenyl)acetamide Formula: C22H34N5O3+ MolecularWeight: 416.53706

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC(=O)N4CCOCC4

Isomeric SMILES

C1CCN(C1)C2=CC=C(C=C2)NC(=O)C[NH+]3CCN(CC3)CC(=O)N4CCOCC4

InChI

InChI=1S/C22H33N5O3/c28-21(23-19-3-5-20(6-4-19)26-7-1-2-8-26)17-24-9-11-25(12-10-24)18-22(29)27-13-15-30-16-14-27/h3-6H,1-2,7-18H2,(H,23,28)/p+1