methyl-[(2-morpholin-4-ylphenyl)methyl]-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium

Systemtic Name: methyl-[(2-morpholin-4-ylphenyl)methyl]-[2-oxidanylidene-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Openeye Name: methyl-[(2-morpholinophenyl)methyl]-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]ammonium CAS Name: methyl-[[2-(4-morpholinyl)phenyl]methyl]-[2-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazinyl]ethyl]ammonium IUPAC Name: methyl-[(2-morpholin-4-ylphenyl)methyl]-[2-oxo-2-(4-pyridin-1-ium-2-ylpiperazin-1-yl)ethyl]azanium Traditional Name: [2-keto-2-(4-pyridin-1-ium-2-ylpiperazino)ethyl]-methyl-(2-morpholinobenzyl)ammonium Formula: C23H33N5O2+2 MolecularWeight: 411.54042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1N2CCOCC2)CC(=O)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C23H31N5O2/c1-25(18-20-6-2-3-7-21(20)26-14-16-30-17-15-26)19-23(29)28-12-10-27(11-13-28)22-8-4-5-9-24-22/h2-9H,10-19H2,1H3/p+2