1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-oxidanylidene-pyridine-3-carboxylic acid

Systemtic Name: 1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-oxidanylidene-pyridine-3-carboxylic acid Openeye Name: 1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-oxo-pyridine-3-carboxylic acid CAS Name: 1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-oxo-3-pyridinecarboxylic acid IUPAC Name: 1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-oxopyridine-3-carboxylic acid Traditional Name: 1-(6-cyano-2,2-dimethyl-1,3-benzoxazin-4-yl)-2-keto-nicotinic acid Formula: C17H13N3O4 MolecularWeight: 323.30282

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Descriptors Computed from Structure

Canonical SMILES:

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)N3C=CC=C(C3=O)C(=O)O)C

Isomeric SMILES

CC1(N=C(C2=C(O1)C=CC(=C2)C#N)N3C=CC=C(C3=O)C(=O)O)C

InChI

InChI=1S/C17H13N3O4/c1-17(2)19-14(12-8-10(9-18)5-6-13(12)24-17)20-7-3-4-11(15(20)21)16(22)23/h3-8H,1-2H3,(H,22,23)