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

Systemtic Name: 2-[[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]-ethanoyl-amino]-4-phenyl-butanoic acid Openeye Name: 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]amino]-4-phenyl-butanoic acid CAS Name: 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]-4-imidazolyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[acetyl-[2-butyl-3-[(2-chlorophenyl)methyl]imidazol-4-yl]amino]-4-phenylbutanoic acid Traditional Name: 2-[acetyl-[2-butyl-3-(2-chlorobenzyl)imidazol-4-yl]amino]-4-phenyl-butyric acid Formula: C26H30ClN3O3 MolecularWeight: 467.9877

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)N(C(CCC3=CC=CC=C3)C(=O)O)C(=O)C

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2Cl)N(C(CCC3=CC=CC=C3)C(=O)O)C(=O)C

InChI

InChI=1S/C26H30ClN3O3/c1-3-4-14-24-28-17-25(29(24)18-21-12-8-9-13-22(21)27)30(19(2)31)23(26(32)33)16-15-20-10-6-5-7-11-20/h5-13,17,23H,3-4,14-16,18H2,1-2H3,(H,32,33)