tert-butyl 2-(4-nitrophenyl)sulfonyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate

Systemtic Name: tert-butyl 2-(4-nitrophenyl)sulfonyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate Openeye Name: tert-butyl 2-(4-nitrophenyl)sulfonyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate CAS Name: 2-(4-nitrophenyl)sulfonyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-nitrophenyl)sulfonyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylate Traditional Name: 2-nosyl-1,3,4,5,6,7-hexahydroisoindole-5-carboxylic acid tert-butyl ester Formula: C19H24N2O6S MolecularWeight: 408.46866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCC2=C(C1)CN(C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)C1CCC2=C(C1)CN(C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H24N2O6S/c1-19(2,3)27-18(22)13-4-5-14-11-20(12-15(14)10-13)28(25,26)17-8-6-16(7-9-17)21(23)24/h6-9,13H,4-5,10-12H2,1-3H3