6-chloranyl-1-methyl-3-octyl-pyrimidine-2,4-dione

Systemtic Name: 6-chloranyl-1-methyl-3-octyl-pyrimidine-2,4-dione Openeye Name: 6-chloro-1-methyl-3-octyl-pyrimidine-2,4-dione CAS Name: 6-chloro-1-methyl-3-octylpyrimidine-2,4-dione IUPAC Name: 6-chloro-1-methyl-3-octylpyrimidine-2,4-dione Traditional Name: 6-chloro-1-methyl-3-octyl-pyrimidine-2,4-quinone Formula: C13H21ClN2O2 MolecularWeight: 272.77104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=O)C=C(N(C1=O)C)Cl

Isomeric SMILES

CCCCCCCCN1C(=O)C=C(N(C1=O)C)Cl

InChI

InChI=1S/C13H21ClN2O2/c1-3-4-5-6-7-8-9-16-12(17)10-11(14)15(2)13(16)18/h10H,3-9H2,1-2H3