1-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-[2-(cyclopropylmethylamino)-2-oxidanylidene-ethyl]-6-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-[2-(cyclopropylmethylamino)-2-oxo-ethyl]-6-oxo-pyridine-3-carboxylic acid CAS Name: 1-[2-(cyclopropylmethylamino)-2-oxoethyl]-6-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-[2-(cyclopropylmethylamino)-2-oxoethyl]-6-oxopyridine-3-carboxylic acid Traditional Name: 1-[2-(cyclopropylmethylamino)-2-keto-ethyl]-6-keto-nicotinic acid Formula: C12H14N2O4 MolecularWeight: 250.25056

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)CN2C=C(C=CC2=O)C(=O)O

Isomeric SMILES

C1CC1CNC(=O)CN2C=C(C=CC2=O)C(=O)O

InChI

InChI=1S/C12H14N2O4/c15-10(13-5-8-1-2-8)7-14-6-9(12(17)18)3-4-11(14)16/h3-4,6,8H,1-2,5,7H2,(H,13,15)(H,17,18)