methyl (2R,3R)-2-[(2,4-dinitrophenyl)amino]-3-oxidanyl-butanoate

Systemtic Name: methyl (2R,3R)-2-[(2,4-dinitrophenyl)amino]-3-oxidanyl-butanoate Openeye Name: methyl (2R,3R)-2-(2,4-dinitroanilino)-3-hydroxy-butanoate CAS Name: (2R,3R)-2-(2,4-dinitroanilino)-3-hydroxybutanoic acid methyl ester IUPAC Name: methyl (2R,3R)-2-(2,4-dinitroanilino)-3-hydroxybutanoate Traditional Name: (2R,3R)-2-(2,4-dinitroanilino)-3-hydroxy-butyric acid methyl ester Formula: C11H13N3O7 MolecularWeight: 299.23682

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)OC)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C[C@H]([C@H](C(=O)OC)NC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C11H13N3O7/c1-6(15)10(11(16)21-2)12-8-4-3-7(13(17)18)5-9(8)14(19)20/h3-6,10,12,15H,1-2H3/t6-,10-/m1/s1