2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; 2-ethyl-3-methyl-quinolin-4-amine

Systemtic Name: 2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; 2-ethyl-3-methyl-quinolin-4-amine Openeye Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid; 2-ethyl-3-methyl-quinolin-4-amine CAS Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid; 2-ethyl-3-methyl-4-quinolinamine IUPAC Name: 2,4-dioxo-1H-pyrimidine-6-carboxylic acid; 2-ethyl-3-methylquinolin-4-amine Traditional Name: (2-ethyl-3-methyl-4-quinolyl)amine; orotic acid Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)N.C1=C(NC(=O)NC1=O)C(=O)O

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)N.C1=C(NC(=O)NC1=O)C(=O)O

InChI

InChI=1S/C12H14N2.C5H4N2O4/c1-3-10-8(2)12(13)9-6-4-5-7-11(9)14-10;8-3-1-2(4(9)10)6-5(11)7-3/h4-7H,3H2,1-2H3,(H2,13,14);1H,(H,9,10)(H2,6,7,8,11)