ethyl 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitro-benzoate

Systemtic Name: ethyl 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitro-benzoate Openeye Name: ethyl 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitro-benzoate CAS Name: 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitrobenzoate Traditional Name: 5-[bis(2-methylsulfonyloxyethyl)amino]-2-nitro-benzoic acid ethyl ester Formula: C15H22N2O10S2 MolecularWeight: 454.47258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H22N2O10S2/c1-4-25-15(18)13-11-12(5-6-14(13)17(19)20)16(7-9-26-28(2,21)22)8-10-27-29(3,23)24/h5-6,11H,4,7-10H2,1-3H3