tert-butyl 2-[4-[2-(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)ethyl]phenyl]-2-cyclopentyl-ethanoate

Systemtic Name: tert-butyl 2-[4-[2-(2-butyl-4-chloranyl-5-methanoyl-imidazol-1-yl)ethyl]phenyl]-2-cyclopentyl-ethanoate Openeye Name: tert-butyl 2-[4-[2-(2-butyl-4-chloro-5-formyl-imidazol-1-yl)ethyl]phenyl]-2-cyclopentyl-acetate CAS Name: 2-[4-[2-(2-butyl-4-chloro-5-formyl-1-imidazolyl)ethyl]phenyl]-2-cyclopentylacetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-[2-(2-butyl-4-chloro-5-formylimidazol-1-yl)ethyl]phenyl]-2-cyclopentylacetate Traditional Name: 2-[4-[2-(2-butyl-4-chloro-5-formyl-imidazol-1-yl)ethyl]phenyl]-2-cyclopentyl-acetic acid tert-butyl ester Formula: C27H37ClN2O3 MolecularWeight: 473.04728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CCC2=CC=C(C=C2)C(C3CCCC3)C(=O)OC(C)(C)C)C=O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CCC2=CC=C(C=C2)C(C3CCCC3)C(=O)OC(C)(C)C)C=O)Cl

InChI

InChI=1S/C27H37ClN2O3/c1-5-6-11-23-29-25(28)22(18-31)30(23)17-16-19-12-14-21(15-13-19)24(20-9-7-8-10-20)26(32)33-27(2,3)4/h12-15,18,20,24H,5-11,16-17H2,1-4H3