6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)pyrimidine-4-carboxylic acid

Systemtic Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)pyrimidine-4-carboxylic acid Openeye Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)pyrimidine-4-carboxylic acid CAS Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)-4-pyrimidinecarboxylic acid IUPAC Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)pyrimidine-4-carboxylic acid Traditional Name: 6-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(dimethylamino)pyrimidine-4-carboxylic acid Formula: C15H15N3O4 MolecularWeight: 301.2973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC(=CC(=N1)C(=O)O)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CN(C)C1=NC(=CC(=N1)C(=O)O)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C15H15N3O4/c1-18(2)15-16-10(8-11(17-15)14(19)20)9-3-4-12-13(7-9)22-6-5-21-12/h3-4,7-8H,5-6H2,1-2H3,(H,19,20)