(2R)-1-[2-azanyl-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]-3-(4-chloranylphenoxy)propan-2-ol

Systemtic Name: (2R)-1-[2-azanyl-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]-3-(4-chloranylphenoxy)propan-2-ol Openeye Name: (2R)-1-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]-3-(4-chlorophenoxy)propan-2-ol CAS Name: (2R)-1-[2-amino-3-(2-diethylaminoethyl)-1-benzimidazol-1-iumyl]-3-(4-chlorophenoxy)-2-propanol IUPAC Name: (2R)-1-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]-3-(4-chlorophenoxy)propan-2-ol Traditional Name: (2R)-1-[2-amino-3-(2-diethylaminoethyl)benzimidazol-1-ium-1-yl]-3-(4-chlorophenoxy)propan-2-ol Formula: C22H30ClN4O2+ MolecularWeight: 417.9522

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C2=CC=CC=C2[N+](=C1N)CC(COC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CCN(CC)CCN1C2=CC=CC=C2[N+](=C1N)C[C@H](COC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C22H29ClN4O2/c1-3-25(4-2)13-14-26-20-7-5-6-8-21(20)27(22(26)24)15-18(28)16-29-19-11-9-17(23)10-12-19/h5-12,18,24,28H,3-4,13-16H2,1-2H3/p+1/t18-/m1/s1