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

Systemtic Name: methyl 4-[(2-butyl-3-methanoyl-2H-imidazol-1-yl)methyl]benzoate Openeye Name: methyl 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoate CAS Name: 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(2-butyl-3-formyl-2H-imidazol-1-yl)methyl]benzoate Traditional Name: 4-[(2-butyl-3-formyl-4-imidazolin-1-yl)methyl]benzoic acid methyl ester Formula: C17H22N2O3 MolecularWeight: 302.36818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1N(C=CN1C=O)CC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CCCCC1N(C=CN1C=O)CC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C17H22N2O3/c1-3-4-5-16-18(10-11-19(16)13-20)12-14-6-8-15(9-7-14)17(21)22-2/h6-11,13,16H,3-5,12H2,1-2H3