[(1S)-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethyl]-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]azanium

Systemtic Name: [(1S)-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethyl]-[(2S)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]azanium Openeye Name: [(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-[(1S)-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethyl]ammonium CAS Name: [(2S)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]-[(1S)-2-(1-methyl-2-benzimidazolyl)-1-phenylethyl]ammonium IUPAC Name: [(2S)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-[(1S)-2-(1-methylbenzimidazol-2-yl)-1-phenylethyl]azanium Traditional Name: [(2S)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-[(1S)-2-(1-methylbenzimidazol-2-yl)-1-phenyl-ethyl]ammonium Formula: C23H32N4O2+2 MolecularWeight: 396.52578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1CC(C3=CC=CC=C3)[NH2+]CC(C[NH+]4CCOCC4)O

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C[C@@H](C3=CC=CC=C3)[NH2+]C[C@@H](C[NH+]4CCOCC4)O

InChI

InChI=1S/C23H30N4O2/c1-26-22-10-6-5-9-20(22)25-23(26)15-21(18-7-3-2-4-8-18)24-16-19(28)17-27-11-13-29-14-12-27/h2-10,19,21,24,28H,11-17H2,1H3/p+2/t19-,21-/m0/s1