2-(1-adamantyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 2-(1-adamantyl)-6-methyl-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-(1-adamantyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 2-(1-adamantyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 2-(1-adamantyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-(1-adamantyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C23CC4CC(C2)CC(C4)C3)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C23CC4CC(C2)CC(C4)C3)C(=O)O

InChI

InChI=1S/C16H20N2O3/c1-8-12(14(20)21)13(19)18-15(17-8)16-5-9-2-10(6-16)4-11(3-9)7-16/h9-11H,2-7H2,1H3,(H,20,21)(H,17,18,19)