methyl 2-[(2,6-dimethylphenyl)-(5-nitro-2-oxidanyl-phenyl)carbonyl-amino]propanoate

Systemtic Name: methyl 2-[(2,6-dimethylphenyl)-(5-nitro-2-oxidanyl-phenyl)carbonyl-amino]propanoate Openeye Name: methyl 2-(N-(2-hydroxy-5-nitro-benzoyl)-2,6-dimethyl-anilino)propanoate CAS Name: 2-(N-[(2-hydroxy-5-nitrophenyl)-oxomethyl]-2,6-dimethylanilino)propanoic acid methyl ester IUPAC Name: methyl 2-(N-(2-hydroxy-5-nitrobenzoyl)-2,6-dimethylanilino)propanoate Traditional Name: 2-(N-(2-hydroxy-5-nitro-benzoyl)-2,6-dimethyl-anilino)propionic acid methyl ester Formula: C19H20N2O6 MolecularWeight: 372.3719

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C(C)C(=O)OC)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C19H20N2O6/c1-11-6-5-7-12(2)17(11)20(13(3)19(24)27-4)18(23)15-10-14(21(25)26)8-9-16(15)22/h5-10,13,22H,1-4H3