2-azanyl-5-[3-(1-benzofuran-2-ylcarbonyl)phenoxy]-2-methyl-5-phenyl-pentanoic acid

Systemtic Name: 2-azanyl-5-[3-(1-benzofuran-2-ylcarbonyl)phenoxy]-2-methyl-5-phenyl-pentanoic acid Openeye Name: 2-amino-5-[3-(benzofuran-2-carbonyl)phenoxy]-2-methyl-5-phenyl-pentanoic acid CAS Name: 2-amino-5-[3-[2-benzofuranyl(oxo)methyl]phenoxy]-2-methyl-5-phenylpentanoic acid IUPAC Name: 2-amino-5-[3-(1-benzofuran-2-carbonyl)phenoxy]-2-methyl-5-phenylpentanoic acid Traditional Name: 2-amino-5-[3-(benzofuran-2-carbonyl)phenoxy]-2-methyl-5-phenyl-valeric acid Formula: C27H25NO5 MolecularWeight: 443.4911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C1=CC=CC=C1)OC2=CC=CC(=C2)C(=O)C3=CC4=CC=CC=C4O3)(C(=O)O)N

Isomeric SMILES

CC(CCC(C1=CC=CC=C1)OC2=CC=CC(=C2)C(=O)C3=CC4=CC=CC=C4O3)(C(=O)O)N

InChI

InChI=1S/C27H25NO5/c1-27(28,26(30)31)15-14-23(18-8-3-2-4-9-18)32-21-12-7-11-20(16-21)25(29)24-17-19-10-5-6-13-22(19)33-24/h2-13,16-17,23H,14-15,28H2,1H3,(H,30,31)