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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=CC=C2OC)CC3=CC=CC=C3CC(C(=O)O)N

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=CC=C2OC)CC3=CC=CC=C3CC(C(=O)O)N

InChI

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