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

Systemtic Name: 2-[[2-butyl-3-[(3-chlorophenyl)methyl]imidazol-4-yl]methylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-butyl-3-[(3-chlorophenyl)methyl]imidazol-4-yl]methylamino]-3-phenyl-propanoic acid CAS Name: 2-[[2-butyl-3-[(3-chlorophenyl)methyl]-4-imidazolyl]methylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-butyl-3-[(3-chlorophenyl)methyl]imidazol-4-yl]methylamino]-3-phenylpropanoic acid Traditional Name: 2-[[2-butyl-3-(3-chlorobenzyl)imidazol-4-yl]methylamino]-3-phenyl-propionic acid Formula: C24H28ClN3O2 MolecularWeight: 425.95102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC(=CC=C2)Cl)CNC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC(=CC=C2)Cl)CNC(CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C24H28ClN3O2/c1-2-3-12-23-27-16-21(28(23)17-19-10-7-11-20(25)13-19)15-26-22(24(29)30)14-18-8-5-4-6-9-18/h4-11,13,16,22,26H,2-3,12,14-15,17H2,1H3,(H,29,30)