ethyl 4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butanoate

Systemtic Name: ethyl 4-[2-[(4-chloranylphenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butanoate Openeye Name: ethyl 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butanoate CAS Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-1-benzimidazolyl]-2-methylbutanoic acid ethyl ester IUPAC Name: ethyl 4-[2-[(4-chlorophenoxy)methyl]-4-methylbenzimidazol-1-yl]-2-methylbutanoate Traditional Name: 4-[2-[(4-chlorophenoxy)methyl]-4-methyl-benzimidazol-1-yl]-2-methyl-butyric acid ethyl ester Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)CCN1C2=CC=CC(=C2N=C1COC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C(C)CCN1C2=CC=CC(=C2N=C1COC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C22H25ClN2O3/c1-4-27-22(26)16(3)12-13-25-19-7-5-6-15(2)21(19)24-20(25)14-28-18-10-8-17(23)9-11-18/h5-11,16H,4,12-14H2,1-3H3