methyl 5-[[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-phenyl]sulfonylamino]methyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[[[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-oxidanyl-phenyl]sulfonylamino]methyl]thiophene-2-carboxylate Openeye Name: methyl 5-[[(3-tert-butoxycarbonyl-4-hydroxy-phenyl)sulfonylamino]methyl]thiophene-2-carboxylate CAS Name: 5-[[[4-hydroxy-3-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]sulfonylamino]methyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[[[4-hydroxy-3-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]sulfonylamino]methyl]thiophene-2-carboxylate Traditional Name: 5-[[(3-tert-butoxycarbonyl-4-hydroxy-phenyl)sulfonylamino]methyl]thiophene-2-carboxylic acid methyl ester Formula: C18H21NO7S2 MolecularWeight: 427.49184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=C(S2)C(=O)OC)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(C=CC(=C1)S(=O)(=O)NCC2=CC=C(S2)C(=O)OC)O

InChI

InChI=1S/C18H21NO7S2/c1-18(2,3)26-16(21)13-9-12(6-7-14(13)20)28(23,24)19-10-11-5-8-15(27-11)17(22)25-4/h5-9,19-20H,10H2,1-4H3