3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]-2-methyl-propanoic acid

Systemtic Name: 3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloranyl-imidazol-4-yl]-2-methyl-propanoic acid Openeye Name: 3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloro-imidazol-4-yl]-2-methyl-propanoic acid CAS Name: 3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloro-4-imidazolyl]-2-methylpropanoic acid IUPAC Name: 3-[3-[(4-aminophenyl)methyl]-2-butyl-5-chloroimidazol-4-yl]-2-methylpropanoic acid Traditional Name: 3-[3-(4-aminobenzyl)-2-butyl-5-chloro-imidazol-4-yl]-2-methyl-propionic acid Formula: C18H24ClN3O2 MolecularWeight: 349.85506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24ClN3O2/c1-3-4-5-16-21-17(19)15(10-12(2)18(23)24)22(16)11-13-6-8-14(20)9-7-13/h6-9,12H,3-5,10-11,20H2,1-2H3,(H,23,24)