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

Systemtic Name: [1-[(2S)-2,3-bis(oxidanyl)propyl]-5,6-dimethoxy-benzimidazol-2-yl]methylazanium Openeye Name: [1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-benzimidazol-2-yl]methylammonium CAS Name: [1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-2-benzimidazolyl]methylammonium IUPAC Name: [1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxybenzimidazol-2-yl]methylazanium Traditional Name: [1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-benzimidazol-2-yl]methylammonium Formula: C13H20N3O4+ MolecularWeight: 282.3156

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC(CO)O)C[NH3+])OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2C[C@@H](CO)O)C[NH3+])OC

InChI

InChI=1S/C13H19N3O4/c1-19-11-3-9-10(4-12(11)20-2)16(6-8(18)7-17)13(5-14)15-9/h3-4,8,17-18H,5-7,14H2,1-2H3/p+1/t8-/m0/s1