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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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