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

Systemtic Name: 2-[[2-butyl-3-[(3-methoxyphenyl)methyl]imidazol-4-yl]methylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-butyl-3-[(3-methoxyphenyl)methyl]imidazol-4-yl]methylamino]-3-phenyl-propanoic acid CAS Name: 2-[[2-butyl-3-[(3-methoxyphenyl)methyl]-4-imidazolyl]methylamino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-butyl-3-[(3-methoxyphenyl)methyl]imidazol-4-yl]methylamino]-3-phenylpropanoic acid Traditional Name: 2-[(2-butyl-3-m-anisyl-imidazol-4-yl)methylamino]-3-phenyl-propionic acid Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31N3O3/c1-3-4-13-24-27-17-21(28(24)18-20-11-8-12-22(14-20)31-2)16-26-23(25(29)30)15-19-9-6-5-7-10-19/h5-12,14,17,23,26H,3-4,13,15-16,18H2,1-2H3,(H,29,30)