2-[4-[3-[tert-butyl(phenylmethoxycarbonyl)amino]propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid

Systemtic Name: 2-[4-[3-[tert-butyl(phenylmethoxycarbonyl)amino]propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid Openeye Name: 2-[4-[3-[benzyloxycarbonyl(tert-butyl)amino]propoxy]-3-methyl-benzofuran-2-yl]oxazole-4-carboxylic acid CAS Name: 2-[4-[3-[tert-butyl(phenylmethoxycarbonyl)amino]propoxy]-3-methyl-2-benzofuranyl]-4-oxazolecarboxylic acid IUPAC Name: 2-[4-[3-[tert-butyl(phenylmethoxycarbonyl)amino]propoxy]-3-methyl-1-benzofuran-2-yl]-1,3-oxazole-4-carboxylic acid Traditional Name: 2-[4-[3-[tert-butyl(carbobenzoxy)amino]propoxy]-3-methyl-benzofuran-2-yl]oxazole-4-carboxylic acid Formula: C28H30N2O7 MolecularWeight: 506.547

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=CC=C2)OCCCN(C(=O)OCC3=CC=CC=C3)C(C)(C)C)C4=NC(=CO4)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C(=CC=C2)OCCCN(C(=O)OCC3=CC=CC=C3)C(C)(C)C)C4=NC(=CO4)C(=O)O

InChI

InChI=1S/C28H30N2O7/c1-18-23-21(12-8-13-22(23)37-24(18)25-29-20(17-35-25)26(31)32)34-15-9-14-30(28(2,3)4)27(33)36-16-19-10-6-5-7-11-19/h5-8,10-13,17H,9,14-16H2,1-4H3,(H,31,32)