O1-tert-butyl O4-ethyl 2-butanoyl-2-(4-nitrophenyl)sulfonyloxy-butanedioate

Systemtic Name: O1-tert-butyl O4-ethyl 2-butanoyl-2-(4-nitrophenyl)sulfonyloxy-butanedioate Openeye Name: O1-tert-butyl O4-ethyl 2-butanoyl-2-(4-nitrophenyl)sulfonyloxy-butanedioate CAS Name: 2-(4-nitrophenyl)sulfonyloxy-2-(1-oxobutyl)butanedioic acid O1-tert-butyl ester O4-ethyl ester IUPAC Name: 1-O-tert-butyl 4-O-ethyl 2-butanoyl-2-(4-nitrophenyl)sulfonyloxybutanedioate Traditional Name: 2-butyryl-2-nosyloxy-succinic acid O1-tert-butyl ester O4-ethyl ester Formula: C20H27NO10S MolecularWeight: 473.49408

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(CC(=O)OCC)(C(=O)OC(C)(C)C)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCC(=O)C(CC(=O)OCC)(C(=O)OC(C)(C)C)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C20H27NO10S/c1-6-8-16(22)20(13-17(23)29-7-2,18(24)30-19(3,4)5)31-32(27,28)15-11-9-14(10-12-15)21(25)26/h9-12H,6-8,13H2,1-5H3