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

Systemtic Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-propoxy-3-propyl-2H-1-benzofuran-2-carboxylic acid Openeye Name: 3-[tert-butoxycarbonyl(tert-butyl)amino]-4-propoxy-3-propyl-2H-benzofuran-2-carboxylic acid CAS Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-propoxy-3-propyl-2H-benzofuran-2-carboxylic acid IUPAC Name: 3-[tert-butyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]-4-propoxy-3-propyl-2H-1-benzofuran-2-carboxylic acid Traditional Name: 3-[tert-butoxycarbonyl(tert-butyl)amino]-4-propoxy-3-propyl-coumaran-2-carboxylic acid Formula: C24H37NO6 MolecularWeight: 435.55368

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(OC2=C1C(=CC=C2)OCCC)C(=O)O)N(C(=O)OC(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCC1(C(OC2=C1C(=CC=C2)OCCC)C(=O)O)N(C(=O)OC(C)(C)C)C(C)(C)C

InChI

InChI=1S/C24H37NO6/c1-9-14-24(25(22(3,4)5)21(28)31-23(6,7)8)18-16(29-15-10-2)12-11-13-17(18)30-19(24)20(26)27/h11-13,19H,9-10,14-15H2,1-8H3,(H,26,27)