[(2S)-3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propyl]-methyl-azanium

Systemtic Name: [(2S)-3-(5,6-dimethylbenzimidazol-1-yl)-2-oxidanyl-propyl]-methyl-azanium Openeye Name: [(2S)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propyl]-methyl-ammonium CAS Name: [(2S)-3-(5,6-dimethyl-1-benzimidazolyl)-2-hydroxypropyl]-methylammonium IUPAC Name: [(2S)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxypropyl]-methylazanium Traditional Name: [(2S)-3-(5,6-dimethylbenzimidazol-1-yl)-2-hydroxy-propyl]-methyl-ammonium Formula: C13H20N3O+ MolecularWeight: 234.3174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C=N2)CC(C[NH2+]C)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C=N2)C[C@H](C[NH2+]C)O

InChI

InChI=1S/C13H19N3O/c1-9-4-12-13(5-10(9)2)16(8-15-12)7-11(17)6-14-3/h4-5,8,11,14,17H,6-7H2,1-3H3/p+1/t11-/m0/s1