ethyl 2-chloranyl-5-[3,4,5-trimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]benzoate

Systemtic Name: ethyl 2-chloranyl-5-[3,4,5-trimethyl-2,6-bis(oxidanylidene)pyrimidin-1-yl]benzoate Openeye Name: ethyl 2-chloro-5-(3,4,5-trimethyl-2,6-dioxo-pyrimidin-1-yl)benzoate CAS Name: 2-chloro-5-(3,4,5-trimethyl-2,6-dioxo-1-pyrimidinyl)benzoic acid ethyl ester IUPAC Name: ethyl 2-chloro-5-(3,4,5-trimethyl-2,6-dioxopyrimidin-1-yl)benzoate Traditional Name: 2-chloro-5-(2,6-diketo-3,4,5-trimethyl-pyrimidin-1-yl)benzoic acid ethyl ester Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C(=C(N(C2=O)C)C)C)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=CC(=C1)N2C(=O)C(=C(N(C2=O)C)C)C)Cl

InChI

InChI=1S/C16H17ClN2O4/c1-5-23-15(21)12-8-11(6-7-13(12)17)19-14(20)9(2)10(3)18(4)16(19)22/h6-8H,5H2,1-4H3