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

Systemtic Name: 2-[4-[2-[1,3-benzoxazol-2-yl(cyclopropylmethyl)amino]ethyl]phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[1,3-benzoxazol-2-yl(cyclopropylmethyl)amino]ethyl]phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[2-[1,3-benzoxazol-2-yl(cyclopropylmethyl)amino]ethyl]phenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[1,3-benzoxazol-2-yl(cyclopropylmethyl)amino]ethyl]phenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[2-[1,3-benzoxazol-2-yl(cyclopropylmethyl)amino]ethyl]phenoxy]-2-methyl-propionic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCN(CC2CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(C)(C(=O)O)OC1=CC=C(C=C1)CCN(CC2CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H26N2O4/c1-23(2,21(26)27)29-18-11-9-16(10-12-18)13-14-25(15-17-7-8-17)22-24-19-5-3-4-6-20(19)28-22/h3-6,9-12,17H,7-8,13-15H2,1-2H3,(H,26,27)