2-[(2,6-dimethyl-3-nitro-phenyl)-(2-methoxyethanoyl)amino]ethanoic acid

Systemtic Name: 2-[(2,6-dimethyl-3-nitro-phenyl)-(2-methoxyethanoyl)amino]ethanoic acid Openeye Name: 2-(N-(2-methoxyacetyl)-2,6-dimethyl-3-nitro-anilino)acetic acid CAS Name: 2-(N-(2-methoxy-1-oxoethyl)-2,6-dimethyl-3-nitroanilino)acetic acid IUPAC Name: 2-(N-(2-methoxyacetyl)-2,6-dimethyl-3-nitroanilino)acetic acid Traditional Name: 2-(N-(2-methoxyacetyl)-2,6-dimethyl-3-nitro-anilino)acetic acid Formula: C13H16N2O6 MolecularWeight: 296.27594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6/c1-8-4-5-10(15(19)20)9(2)13(8)14(6-12(17)18)11(16)7-21-3/h4-5H,6-7H2,1-3H3,(H,17,18)