methyl (2R)-2-[(4-methoxy-2-nitro-phenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2R)-2-[(4-methoxy-2-nitro-phenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: methyl (2R)-2-[(4-methoxy-2-nitro-phenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2R)-2-[(4-methoxy-2-nitrophenyl)sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2R)-2-[(4-methoxy-2-nitrophenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2R)-2-[(4-methoxy-2-nitro-phenyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C13H18N2O7S MolecularWeight: 346.35622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)[C@H](C(=O)OC)NS(=O)(=O)C1=C(C=C(C=C1)OC)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O7S/c1-8(2)12(13(16)22-4)14-23(19,20)11-6-5-9(21-3)7-10(11)15(17)18/h5-8,12,14H,1-4H3/t12-/m1/s1