N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(1S,2R)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1S,2R)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(1R,2S)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetamide Formula: C24H36N5O2+3 MolecularWeight: 426.57494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[NH+]2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

C[C@H]([C@H](C1=CC=CC=C1)[NH+]2CCOCC2)NC(=O)C[NH+]3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C24H33N5O2/c1-20(24(21-7-3-2-4-8-21)29-15-17-31-18-16-29)26-23(30)19-27-11-13-28(14-12-27)22-9-5-6-10-25-22/h2-10,20,24H,11-19H2,1H3,(H,26,30)/p+3/t20-,24-/m1/s1