ethyl 6-methyl-3-(4-nitrophenyl)sulfonyloxy-4-oxidanylidene-heptanoate

Systemtic Name: ethyl 6-methyl-3-(4-nitrophenyl)sulfonyloxy-4-oxidanylidene-heptanoate Openeye Name: ethyl 6-methyl-3-(4-nitrophenyl)sulfonyloxy-4-oxo-heptanoate CAS Name: 6-methyl-3-(4-nitrophenyl)sulfonyloxy-4-oxoheptanoic acid ethyl ester IUPAC Name: ethyl 6-methyl-3-(4-nitrophenyl)sulfonyloxy-4-oxoheptanoate Traditional Name: 4-keto-6-methyl-3-nosyloxy-enanthic acid ethyl ester Formula: C16H21NO8S MolecularWeight: 387.40484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)CC(C)C)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC(C(=O)CC(C)C)OS(=O)(=O)C1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C16H21NO8S/c1-4-24-16(19)10-15(14(18)9-11(2)3)25-26(22,23)13-7-5-12(6-8-13)17(20)21/h5-8,11,15H,4,9-10H2,1-3H3