2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; 5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine

Systemtic Name: 2,4-bis(oxidanylidene)-1H-pyrimidine-6-carboxylic acid; 5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine Openeye Name: 5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid CAS Name: 5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid IUPAC Name: 5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-amine; 2,4-dioxo-1H-pyrimidine-6-carboxylic acid Traditional Name: (5,7-dimethyl-1,2,3,4-tetrahydroacridin-9-yl)amine; orotic acid Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=C3CCCCC3=N2)N)C.C1=C(NC(=O)NC1=O)C(=O)O

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=C3CCCCC3=N2)N)C.C1=C(NC(=O)NC1=O)C(=O)O

InChI

InChI=1S/C15H18N2.C5H4N2O4/c1-9-7-10(2)15-12(8-9)14(16)11-5-3-4-6-13(11)17-15;8-3-1-2(4(9)10)6-5(11)7-3/h7-8H,3-6H2,1-2H3,(H2,16,17);1H,(H,9,10)(H2,6,7,8,11)