3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]thiophen-2-yl]-1,3-benzoxazol-5-yl]propanoic acid

Systemtic Name: 3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]thiophen-2-yl]-1,3-benzoxazol-5-yl]propanoic acid Openeye Name: 3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]-2-thienyl]-1,3-benzoxazol-5-yl]propanoic acid CAS Name: 3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]-2-thiophenyl]-1,3-benzoxazol-5-yl]propanoic acid IUPAC Name: 3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]thiophen-2-yl]-1,3-benzoxazol-5-yl]propanoic acid Traditional Name: 3-[7-tert-butyl-2-[5-[7-tert-butyl-5-(2-carboxyethyl)-1,3-benzoxazol-2-yl]-2-thienyl]-1,3-benzoxazol-5-yl]propionic acid Formula: C32H34N2O6S MolecularWeight: 574.68716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=CC(=C1)CCC(=O)O)N=C(O2)C3=CC=C(S3)C4=NC5=CC(=CC(=C5O4)C(C)(C)C)CCC(=O)O

Isomeric SMILES

CC(C)(C)C1=C2C(=CC(=C1)CCC(=O)O)N=C(O2)C3=CC=C(S3)C4=NC5=CC(=CC(=C5O4)C(C)(C)C)CCC(=O)O

InChI

InChI=1S/C32H34N2O6S/c1-31(2,3)19-13-17(7-11-25(35)36)15-21-27(19)39-29(33-21)23-9-10-24(41-23)30-34-22-16-18(8-12-26(37)38)14-20(28(22)40-30)32(4,5)6/h9-10,13-16H,7-8,11-12H2,1-6H3,(H,35,36)(H,37,38)