methyl 3-(2-butyl-4-methanoyl-imidazol-1-yl)propanoate

Systemtic Name: methyl 3-(2-butyl-4-methanoyl-imidazol-1-yl)propanoate Openeye Name: methyl 3-(2-butyl-4-formyl-imidazol-1-yl)propanoate CAS Name: 3-(2-butyl-4-formyl-1-imidazolyl)propanoic acid methyl ester IUPAC Name: methyl 3-(2-butyl-4-formylimidazol-1-yl)propanoate Traditional Name: 3-(2-butyl-4-formyl-imidazol-1-yl)propionic acid methyl ester Formula: C12H18N2O3 MolecularWeight: 238.28292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=CN1CCC(=O)OC)C=O

Isomeric SMILES

CCCCC1=NC(=CN1CCC(=O)OC)C=O

InChI

InChI=1S/C12H18N2O3/c1-3-4-5-11-13-10(9-15)8-14(11)7-6-12(16)17-2/h8-9H,3-7H2,1-2H3