ethyl 2-nitro-4-(phenylsulfonyl)-2-[2-(phenylsulfonyl)ethyl]butanoate

Systemtic Name: ethyl 2-nitro-4-(phenylsulfonyl)-2-[2-(phenylsulfonyl)ethyl]butanoate Openeye Name: ethyl 4-(benzenesulfonyl)-2-[2-(benzenesulfonyl)ethyl]-2-nitro-butanoate CAS Name: 4-(benzenesulfonyl)-2-[2-(benzenesulfonyl)ethyl]-2-nitrobutanoic acid ethyl ester IUPAC Name: ethyl 4-(benzenesulfonyl)-2-[2-(benzenesulfonyl)ethyl]-2-nitrobutanoate Traditional Name: 4-besyl-2-(2-besylethyl)-2-nitro-butyric acid ethyl ester Formula: C20H23NO8S2 MolecularWeight: 469.52852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCS(=O)(=O)C1=CC=CC=C1)(CCS(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C(CCS(=O)(=O)C1=CC=CC=C1)(CCS(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H23NO8S2/c1-2-29-19(22)20(21(23)24,13-15-30(25,26)17-9-5-3-6-10-17)14-16-31(27,28)18-11-7-4-8-12-18/h3-12H,2,13-16H2,1H3