(2S)-3-[2-(3-azanylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]propane-1,2-diol

Systemtic Name: (2S)-3-[2-(3-azanylpropyl)-5,6-dimethoxy-benzimidazol-1-yl]propane-1,2-diol Openeye Name: (2S)-3-[2-(3-aminopropyl)-5,6-dimethoxy-benzimidazol-1-yl]propane-1,2-diol CAS Name: (2S)-3-[2-(3-aminopropyl)-5,6-dimethoxy-1-benzimidazolyl]propane-1,2-diol IUPAC Name: (2S)-3-[2-(3-aminopropyl)-5,6-dimethoxybenzimidazol-1-yl]propane-1,2-diol Traditional Name: (2S)-3-[2-(3-aminopropyl)-5,6-dimethoxy-benzimidazol-1-yl]propane-1,2-diol Formula: C15H23N3O4 MolecularWeight: 309.36082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=C(N2CC(CO)O)CCCN)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)N=C(N2C[C@@H](CO)O)CCCN)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/t10-/m0/s1