2-[3-(2-acetyloxyethyl)-5,6-bis(chloranyl)-2-methyl-benzimidazol-3-ium-1-yl]ethyl ethanoate

Systemtic Name: 2-[3-(2-acetyloxyethyl)-5,6-bis(chloranyl)-2-methyl-benzimidazol-3-ium-1-yl]ethyl ethanoate Openeye Name: 2-[3-(2-acetoxyethyl)-5,6-dichloro-2-methyl-benzimidazol-3-ium-1-yl]ethyl acetate CAS Name: acetic acid 2-[3-(2-acetyloxyethyl)-5,6-dichloro-2-methyl-1-benzimidazol-3-iumyl]ethyl ester IUPAC Name: 2-[3-(2-acetyloxyethyl)-5,6-dichloro-2-methylbenzimidazol-3-ium-1-yl]ethyl acetate Traditional Name: acetic acid 2-[3-(2-acetoxyethyl)-5,6-dichloro-2-methyl-benzimidazol-3-ium-1-yl]ethyl ester Formula: C16H19Cl2N2O4+ MolecularWeight: 374.23906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC(=C(C=C2N1CCOC(=O)C)Cl)Cl)CCOC(=O)C

Isomeric SMILES

CC1=[N+](C2=CC(=C(C=C2N1CCOC(=O)C)Cl)Cl)CCOC(=O)C

InChI

InChI=1S/C16H19Cl2N2O4/c1-10-19(4-6-23-11(2)21)15-8-13(17)14(18)9-16(15)20(10)5-7-24-12(3)22/h8-9H,4-7H2,1-3H3/q+1