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

Systemtic Name: 3-[1-[(2S)-2,3-bis(oxidanyl)propyl]-5,6-dimethoxy-benzimidazol-2-yl]propylazanium Openeye Name: 3-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-benzimidazol-2-yl]propylammonium CAS Name: 3-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-2-benzimidazolyl]propylammonium IUPAC Name: 3-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxybenzimidazol-2-yl]propylazanium Traditional Name: 3-[1-[(2S)-2,3-dihydroxypropyl]-5,6-dimethoxy-benzimidazol-2-yl]propylammonium Formula: C15H24N3O4+ MolecularWeight: 310.36876

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O4/c1-21-13-6-11-12(7-14(13)22-2)18(8-10(20)9-19)15(17-11)4-3-5-16/h6-7,10,19-20H,3-5,8-9,16H2,1-2H3/p+1/t10-/m0/s1