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

Systemtic Name: (2S)-3-[2-[(1S)-1-azanylpropyl]-5,6-dimethyl-benzimidazol-1-yl]propane-1,2-diol Openeye Name: (2S)-3-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-benzimidazol-1-yl]propane-1,2-diol CAS Name: (2S)-3-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-1-benzimidazolyl]propane-1,2-diol IUPAC Name: (2S)-3-[2-[(1S)-1-aminopropyl]-5,6-dimethylbenzimidazol-1-yl]propane-1,2-diol Traditional Name: (2S)-3-[2-[(1S)-1-aminopropyl]-5,6-dimethyl-benzimidazol-1-yl]propane-1,2-diol Formula: C15H23N3O2 MolecularWeight: 277.36202

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=C(N1CC(CO)O)C=C(C(=C2)C)C)N

Isomeric SMILES

CC[C@@H](C1=NC2=C(N1C[C@@H](CO)O)C=C(C(=C2)C)C)N

InChI

InChI=1S/C15H23N3O2/c1-4-12(16)15-17-13-5-9(2)10(3)6-14(13)18(15)7-11(20)8-19/h5-6,11-12,19-20H,4,7-8,16H2,1-3H3/t11-,12-/m0/s1