3-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(ethoxymethyl)-4-propoxy-2H-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(ethoxymethyl)-4-propoxy-2H-1-benzofuran-2-carboxylic acid Openeye Name: 3-[tert-butoxycarbonyl(tert-butyl)amino]-3-(ethoxymethyl)-4-propoxy-2H-benzofuran-2-carboxylic acid CAS Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(ethoxymethyl)-4-propoxy-2H-benzofuran-2-carboxylic acid IUPAC Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-3-(ethoxymethyl)-4-propoxy-2H-1-benzofuran-2-carboxylic acid Traditional Name: 3-[tert-butoxycarbonyl(tert-butyl)amino]-3-(ethoxymethyl)-4-propoxy-coumaran-2-carboxylic acid Formula: C24H37NO7 MolecularWeight: 451.55308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC2=C1C(C(O2)C(=O)O)(COCC)N(C(=O)OC(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCOC1=CC=CC2=C1C(C(O2)C(=O)O)(COCC)N(C(=O)OC(C)(C)C)C(C)(C)C

InChI

InChI=1S/C24H37NO7/c1-9-14-30-16-12-11-13-17-18(16)24(15-29-10-2,19(31-17)20(26)27)25(22(3,4)5)21(28)32-23(6,7)8/h11-13,19H,9-10,14-15H2,1-8H3,(H,26,27)