methyl 2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-nitrophenyl)methylsulfonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoate CAS Name: 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(4-nitrophenyl)methylsulfonylamino]propanoate Traditional Name: 3-hydroxy-2-[(4-nitrobenzyl)sulfonylamino]propionic acid methyl ester Formula: C11H14N2O7S MolecularWeight: 318.30306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NS(=O)(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C(CO)NS(=O)(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C11H14N2O7S/c1-20-11(15)10(6-14)12-21(18,19)7-8-2-4-9(5-3-8)13(16)17/h2-5,10,12,14H,6-7H2,1H3