3-azanyl-6-[(E)-3,3-dimethylbut-1-enyl]-2-oxidanylidene-pyridine-1-carboxylic acid

Systemtic Name: 3-azanyl-6-[(E)-3,3-dimethylbut-1-enyl]-2-oxidanylidene-pyridine-1-carboxylic acid Openeye Name: 3-amino-6-[(E)-3,3-dimethylbut-1-enyl]-2-oxo-pyridine-1-carboxylic acid CAS Name: 3-amino-6-[(E)-3,3-dimethylbut-1-enyl]-2-oxo-1-pyridinecarboxylic acid IUPAC Name: 3-amino-6-[(E)-3,3-dimethylbut-1-enyl]-2-oxopyridine-1-carboxylic acid Traditional Name: 3-amino-6-[(E)-3,3-dimethylbut-1-enyl]-2-keto-pyridine-1-carboxylic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C=CC1=CC=C(C(=O)N1C(=O)O)N

Isomeric SMILES

CC(C)(C)/C=C/C1=CC=C(C(=O)N1C(=O)O)N

InChI

InChI=1S/C12H16N2O3/c1-12(2,3)7-6-8-4-5-9(13)10(15)14(8)11(16)17/h4-7H,13H2,1-3H3,(H,16,17)/b7-6+