(1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol

Systemtic Name: (1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol Openeye Name: (1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol CAS Name: (1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol IUPAC Name: (1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol Traditional Name: (1S,2S)-1,2-bis(6-propoxy-1H-benzimidazol-2-yl)ethane-1,2-diol Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC2=C(C=C1)N=C(N2)C(C(C3=NC4=C(N3)C=C(C=C4)OCCC)O)O

Isomeric SMILES

CCCOC1=CC2=C(C=C1)N=C(N2)[C@@H]([C@H](C3=NC4=C(N3)C=C(C=C4)OCCC)O)O

InChI

InChI=1S/C22H26N4O4/c1-3-9-29-13-5-7-15-17(11-13)25-21(23-15)19(27)20(28)22-24-16-8-6-14(30-10-4-2)12-18(16)26-22/h5-8,11-12,19-20,27-28H,3-4,9-10H2,1-2H3,(H,23,25)(H,24,26)/t19-,20-/m1/s1