(1R)-2-[2-azanyl-3-[(2-methylphenyl)methyl]benzimidazol-3-ium-1-yl]-1-(furan-2-yl)ethanol

Systemtic Name: (1R)-2-[2-azanyl-3-[(2-methylphenyl)methyl]benzimidazol-3-ium-1-yl]-1-(furan-2-yl)ethanol Openeye Name: (1R)-2-[2-amino-3-(o-tolylmethyl)benzimidazol-3-ium-1-yl]-1-(2-furyl)ethanol CAS Name: (1R)-2-[2-amino-3-[(2-methylphenyl)methyl]-1-benzimidazol-3-iumyl]-1-(2-furanyl)ethanol IUPAC Name: (1R)-2-[2-amino-3-[(2-methylphenyl)methyl]benzimidazol-3-ium-1-yl]-1-(furan-2-yl)ethanol Traditional Name: (1R)-2-[2-amino-3-(2-methylbenzyl)benzimidazol-3-ium-1-yl]-1-(2-furyl)ethanol Formula: C21H22N3O2+ MolecularWeight: 348.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[N+]2=C(N(C3=CC=CC=C32)CC(C4=CC=CO4)O)N

Isomeric SMILES

CC1=CC=CC=C1C[N+]2=C(N(C3=CC=CC=C32)C[C@H](C4=CC=CO4)O)N

InChI

InChI=1S/C21H21N3O2/c1-15-7-2-3-8-16(15)13-23-17-9-4-5-10-18(17)24(21(23)22)14-19(25)20-11-6-12-26-20/h2-12,19,22,25H,13-14H2,1H3/p+1/t19-/m1/s1