2-[3-[[1,3-benzoxazol-2-yl-[(4-chlorophenyl)methyl]amino]methyl]phenoxy]propanoic acid

Systemtic Name: 2-[3-[[1,3-benzoxazol-2-yl-[(4-chlorophenyl)methyl]amino]methyl]phenoxy]propanoic acid Openeye Name: 2-[3-[[1,3-benzoxazol-2-yl-[(4-chlorophenyl)methyl]amino]methyl]phenoxy]propanoic acid CAS Name: 2-[3-[[1,3-benzoxazol-2-yl-[(4-chlorophenyl)methyl]amino]methyl]phenoxy]propanoic acid IUPAC Name: 2-[3-[[1,3-benzoxazol-2-yl-[(4-chlorophenyl)methyl]amino]methyl]phenoxy]propanoic acid Traditional Name: 2-[3-[[1,3-benzoxazol-2-yl-(4-chlorobenzyl)amino]methyl]phenoxy]propionic acid Formula: C24H21ClN2O4 MolecularWeight: 436.88754

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C(=O)O)OC1=CC=CC(=C1)CN(CC2=CC=C(C=C2)Cl)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C24H21ClN2O4/c1-16(23(28)29)30-20-6-4-5-18(13-20)15-27(14-17-9-11-19(25)12-10-17)24-26-21-7-2-3-8-22(21)31-24/h2-13,16H,14-15H2,1H3,(H,28,29)