[(E)-3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]-3-oxidanyl-prop-1-enyl] ethanoate

Systemtic Name: [(E)-3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]-3-oxidanyl-prop-1-enyl] ethanoate Openeye Name: [(E)-3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloro-imidazol-4-yl]-3-hydroxy-prop-1-enyl] acetate CAS Name: acetic acid [(E)-3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloro-4-imidazolyl]-3-hydroxyprop-1-enyl] ester IUPAC Name: [(E)-3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloroimidazol-4-yl]-3-hydroxyprop-1-enyl] acetate Traditional Name: acetic acid [(E)-3-[3-(4-aminobenzyl)-2-butyl-5-chloro-imidazol-4-yl]-3-hydroxy-prop-1-enyl] ester Formula: C19H24ClN3O3 MolecularWeight: 377.86516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)N)C(C=COC(=O)C)O)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)N)C(/C=C/OC(=O)C)O)Cl

InChI

InChI=1S/C19H24ClN3O3/c1-3-4-5-17-22-19(20)18(16(25)10-11-26-13(2)24)23(17)12-14-6-8-15(21)9-7-14/h6-11,16,25H,3-5,12,21H2,1-2H3/b11-10+