methyl 4-[(2-butyl-5-methanoyl-imidazol-1-yl)methyl]-3-chloranyl-benzoate

Systemtic Name: methyl 4-[(2-butyl-5-methanoyl-imidazol-1-yl)methyl]-3-chloranyl-benzoate Openeye Name: methyl 4-[(2-butyl-5-formyl-imidazol-1-yl)methyl]-3-chloro-benzoate CAS Name: 4-[(2-butyl-5-formyl-1-imidazolyl)methyl]-3-chlorobenzoic acid methyl ester IUPAC Name: methyl 4-[(2-butyl-5-formylimidazol-1-yl)methyl]-3-chlorobenzoate Traditional Name: 4-[(2-butyl-5-formyl-imidazol-1-yl)methyl]-3-chloro-benzoic acid methyl ester Formula: C17H19ClN2O3 MolecularWeight: 334.79736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=C(C=C(C=C2)C(=O)OC)Cl)C=O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=C(C=C(C=C2)C(=O)OC)Cl)C=O

InChI

InChI=1S/C17H19ClN2O3/c1-3-4-5-16-19-9-14(11-21)20(16)10-13-7-6-12(8-15(13)18)17(22)23-2/h6-9,11H,3-5,10H2,1-2H3