2-[2-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethanoyl-pyridin-4-yl-amino]propanoic acid

Systemtic Name: 2-[2-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]ethanoyl-pyridin-4-yl-amino]propanoic acid Openeye Name: 2-[[2-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]acetyl]-(4-pyridyl)amino]propanoic acid CAS Name: 2-[[2-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]-1-oxoethyl]-pyridin-4-ylamino]propanoic acid IUPAC Name: 2-[[2-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]acetyl]-pyridin-4-ylamino]propanoic acid Traditional Name: 2-[[2-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]acetyl]-(4-pyridyl)amino]propionic acid Formula: C24H27ClN4O3 MolecularWeight: 454.94918

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN4O3/c1-3-4-9-22-27-15-20(28(22)16-18-7-5-6-8-21(18)25)14-23(30)29(17(2)24(31)32)19-10-12-26-13-11-19/h5-8,10-13,15,17H,3-4,9,14,16H2,1-2H3,(H,31,32)