2-[1-[(2S)-2,3-bis(oxidanyl)propyl]-5,6-dimethyl-benzimidazol-2-yl]ethylazanium

Systemtic Name: 2-[1-[(2S)-2,3-bis(oxidanyl)propyl]-5,6-dimethyl-benzimidazol-2-yl]ethylazanium Openeye Name: 2-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethyl-benzimidazol-2-yl]ethylammonium CAS Name: 2-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethyl-2-benzimidazolyl]ethylammonium IUPAC Name: 2-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethylbenzimidazol-2-yl]ethylazanium Traditional Name: 2-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethyl-benzimidazol-2-yl]ethylammonium Formula: C14H22N3O2+ MolecularWeight: 264.34338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH3+])CC(CO)O

Isomeric SMILES

CC1=CC2=C(C=C1C)N(C(=N2)CC[NH3+])C[C@@H](CO)O

InChI

InChI=1S/C14H21N3O2/c1-9-5-12-13(6-10(9)2)17(7-11(19)8-18)14(16-12)3-4-15/h5-6,11,18-19H,3-4,7-8,15H2,1-2H3/p+1/t11-/m0/s1