2-chloranyl-5-[3,4,5-trimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: 2-chloranyl-5-[3,4,5-trimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]cyclohexa-1,4-diene-1-carboxylate Openeye Name: 2-chloro-5-(3,4,5-trimethyl-2,6-dioxo-pyrimidin-1-yl)cyclohexa-1,4-diene-1-carboxylate CAS Name: 2-chloro-5-(3,4,5-trimethyl-2,6-dioxo-1-pyrimidinyl)-1-cyclohexa-1,4-dienecarboxylate IUPAC Name: 2-chloro-5-(3,4,5-trimethyl-2,6-dioxopyrimidin-1-yl)cyclohexa-1,4-diene-1-carboxylate Traditional Name: 2-chloro-5-(2,6-diketo-3,4,5-trimethyl-pyrimidin-1-yl)cyclohexa-1,4-diene-1-carboxylate Formula: C14H14ClN2O4- MolecularWeight: 309.72496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=O)N(C1=O)C2=CCC(=C(C2)C(=O)[O-])Cl)C)C

Isomeric SMILES

CC1=C(N(C(=O)N(C1=O)C2=CCC(=C(C2)C(=O)[O-])Cl)C)C

InChI

InChI=1S/C14H15ClN2O4/c1-7-8(2)16(3)14(21)17(12(7)18)9-4-5-11(15)10(6-9)13(19)20/h4H,5-6H2,1-3H3,(H,19,20)/p-1