3-[(Z)-2-(dimethylamino)prop-1-enoxy]carbonyl-5-nitro-pyridine-2-carboxylic acid

Systemtic Name: 3-[(Z)-2-(dimethylamino)prop-1-enoxy]carbonyl-5-nitro-pyridine-2-carboxylic acid Openeye Name: 3-[(Z)-2-(dimethylamino)prop-1-enoxy]carbonyl-5-nitro-pyridine-2-carboxylic acid CAS Name: 3-[[(Z)-2-(dimethylamino)prop-1-enoxy]-oxomethyl]-5-nitro-2-pyridinecarboxylic acid IUPAC Name: 3-[(Z)-2-(dimethylamino)prop-1-enoxy]carbonyl-5-nitropyridine-2-carboxylic acid Traditional Name: 3-[(Z)-2-(dimethylamino)prop-1-enoxy]carbonyl-5-nitro-picolinic acid Formula: C12H13N3O6 MolecularWeight: 295.24812

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Descriptors Computed from Structure

Canonical SMILES:

CC(=COC(=O)C1=CC(=CN=C1C(=O)O)[N+](=O)[O-])N(C)C

Isomeric SMILES

C/C(=C/OC(=O)C1=CC(=CN=C1C(=O)O)[N+](=O)[O-])/N(C)C

InChI

InChI=1S/C12H13N3O6/c1-7(14(2)3)6-21-12(18)9-4-8(15(19)20)5-13-10(9)11(16)17/h4-6H,1-3H3,(H,16,17)/b7-6-