tert-butyl N-[2-(2-methoxyphenyl)ethyl]-N-[5-oxidanylidene-5-(7-sulfamoyl-2,3-dihydro-1-benzofuran-5-yl)pentyl]carbamate

Systemtic Name: tert-butyl N-[2-(2-methoxyphenyl)ethyl]-N-[5-oxidanylidene-5-(7-sulfamoyl-2,3-dihydro-1-benzofuran-5-yl)pentyl]carbamate Openeye Name: tert-butyl N-[2-(2-methoxyphenyl)ethyl]-N-[5-oxo-5-(7-sulfamoyl-2,3-dihydrobenzofuran-5-yl)pentyl]carbamate CAS Name: N-[2-(2-methoxyphenyl)ethyl]-N-[5-oxo-5-(7-sulfamoyl-2,3-dihydrobenzofuran-5-yl)pentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-(2-methoxyphenyl)ethyl]-N-[5-oxo-5-(7-sulfamoyl-2,3-dihydro-1-benzofuran-5-yl)pentyl]carbamate Traditional Name: N-[5-keto-5-(7-sulfamoylcoumaran-5-yl)pentyl]-N-[2-(2-methoxyphenyl)ethyl]carbamic acid tert-butyl ester Formula: C27H36N2O7S MolecularWeight: 532.64894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCCCC(=O)C1=CC2=C(C(=C1)S(=O)(=O)N)OCC2)CCC3=CC=CC=C3OC

Isomeric SMILES

CC(C)(C)OC(=O)N(CCCCC(=O)C1=CC2=C(C(=C1)S(=O)(=O)N)OCC2)CCC3=CC=CC=C3OC

InChI

InChI=1S/C27H36N2O7S/c1-27(2,3)36-26(31)29(15-12-19-9-5-6-11-23(19)34-4)14-8-7-10-22(30)21-17-20-13-16-35-25(20)24(18-21)37(28,32)33/h5-6,9,11,17-18H,7-8,10,12-16H2,1-4H3,(H2,28,32,33)