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

Systemtic Name: 4-[1,3-benzoxazol-2-yl(propan-2-yl)amino]-2-methyl-2-phenoxy-hexanoic acid Openeye Name: 4-[1,3-benzoxazol-2-yl(isopropyl)amino]-2-methyl-2-phenoxy-hexanoic acid CAS Name: 4-[1,3-benzoxazol-2-yl(propan-2-yl)amino]-2-methyl-2-phenoxyhexanoic acid IUPAC Name: 4-[1,3-benzoxazol-2-yl(propan-2-yl)amino]-2-methyl-2-phenoxyhexanoic acid Traditional Name: 4-[1,3-benzoxazol-2-yl(isopropyl)amino]-2-methyl-2-phenoxy-hexanoic acid Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(C)(C(=O)O)OC1=CC=CC=C1)N(C2=NC3=CC=CC=C3O2)C(C)C

Isomeric SMILES

CCC(CC(C)(C(=O)O)OC1=CC=CC=C1)N(C2=NC3=CC=CC=C3O2)C(C)C

InChI

InChI=1S/C23H28N2O4/c1-5-17(15-23(4,21(26)27)29-18-11-7-6-8-12-18)25(16(2)3)22-24-19-13-9-10-14-20(19)28-22/h6-14,16-17H,5,15H2,1-4H3,(H,26,27)