2-(2-methylbenzimidazol-1-yl)ethyl-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]azanium

Systemtic Name: 2-(2-methylbenzimidazol-1-yl)ethyl-[(1S)-2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl]azanium Openeye Name: 2-(2-methylbenzimidazol-1-yl)ethyl-[(1S)-2-morpholino-2-oxo-1-phenyl-ethyl]ammonium CAS Name: 2-(2-methyl-1-benzimidazolyl)ethyl-[(1S)-2-(4-morpholinyl)-2-oxo-1-phenylethyl]ammonium IUPAC Name: 2-(2-methylbenzimidazol-1-yl)ethyl-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]azanium Traditional Name: [(1S)-2-keto-2-morpholino-1-phenyl-ethyl]-[2-(2-methylbenzimidazol-1-yl)ethyl]ammonium Formula: C22H27N4O2+ MolecularWeight: 379.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CC[NH2+]C(C3=CC=CC=C3)C(=O)N4CCOCC4

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CC[NH2+][C@@H](C3=CC=CC=C3)C(=O)N4CCOCC4

InChI

InChI=1S/C22H26N4O2/c1-17-24-19-9-5-6-10-20(19)26(17)12-11-23-21(18-7-3-2-4-8-18)22(27)25-13-15-28-16-14-25/h2-10,21,23H,11-16H2,1H3/p+1/t21-/m0/s1