2-[1-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethylamino]-2-methyl-3-phenyl-propanoic acid

Systemtic Name: 2-[1-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethylamino]-2-methyl-3-phenyl-propanoic acid Openeye Name: 2-[1-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethylamino]-2-methyl-3-phenyl-propanoic acid CAS Name: 2-[1-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]ethylamino]-2-methyl-3-phenylpropanoic acid IUPAC Name: 2-[1-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethylamino]-2-methyl-3-phenylpropanoic acid Traditional Name: 2-[1-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]ethylamino]-2-methyl-3-phenyl-propionic acid Formula: C26H32ClN3O2 MolecularWeight: 454.00418

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C(C)NC(C)(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)C(C)NC(C)(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C26H32ClN3O2/c1-4-5-15-24-28-17-23(30(24)18-21-13-9-10-14-22(21)27)19(2)29-26(3,25(31)32)16-20-11-7-6-8-12-20/h6-14,17,19,29H,4-5,15-16,18H2,1-3H3,(H,31,32)