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

Systemtic Name: 4-[1,3-benzoxazol-2-yl(cyclohexyl)amino]-2-methyl-2-phenoxy-pentanoic acid Openeye Name: 4-[1,3-benzoxazol-2-yl(cyclohexyl)amino]-2-methyl-2-phenoxy-pentanoic acid CAS Name: 4-[1,3-benzoxazol-2-yl(cyclohexyl)amino]-2-methyl-2-phenoxypentanoic acid IUPAC Name: 4-[1,3-benzoxazol-2-yl(cyclohexyl)amino]-2-methyl-2-phenoxypentanoic acid Traditional Name: 4-[1,3-benzoxazol-2-yl(cyclohexyl)amino]-2-methyl-2-phenoxy-valeric acid Formula: C25H30N2O4 MolecularWeight: 422.5167

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(C)(C(=O)O)OC1=CC=CC=C1)N(C2CCCCC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

CC(CC(C)(C(=O)O)OC1=CC=CC=C1)N(C2CCCCC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C25H30N2O4/c1-18(17-25(2,23(28)29)31-20-13-7-4-8-14-20)27(19-11-5-3-6-12-19)24-26-21-15-9-10-16-22(21)30-24/h4,7-10,13-16,18-19H,3,5-6,11-12,17H2,1-2H3,(H,28,29)