(2R)-1-(2-azanyl-3-prop-2-enyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol

Systemtic Name: (2R)-1-(2-azanyl-3-prop-2-enyl-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol Openeye Name: (2R)-1-(3-allyl-2-amino-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol CAS Name: (2R)-1-(2-amino-3-prop-2-enyl-1-benzimidazol-3-iumyl)-3-phenoxy-2-propanol IUPAC Name: (2R)-1-(2-amino-3-prop-2-enylbenzimidazol-3-ium-1-yl)-3-phenoxypropan-2-ol Traditional Name: (2R)-1-(3-allyl-2-amino-benzimidazol-3-ium-1-yl)-3-phenoxy-propan-2-ol Formula: C19H22N3O2+ MolecularWeight: 324.39688

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[N+]1=C(N(C2=CC=CC=C21)CC(COC3=CC=CC=C3)O)N

Isomeric SMILES

C=CC[N+]1=C(N(C2=CC=CC=C21)C[C@H](COC3=CC=CC=C3)O)N

InChI

InChI=1S/C19H21N3O2/c1-2-12-21-17-10-6-7-11-18(17)22(19(21)20)13-15(23)14-24-16-8-4-3-5-9-16/h2-11,15,20,23H,1,12-14H2/p+1/t15-/m1/s1