(4-chloranyl-2-cyclohexyl-phenyl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate

Systemtic Name: (4-chloranyl-2-cyclohexyl-phenyl) 1,3-dimethyl-2,4-bis(oxidanylidene)pyrimidine-5-sulfonate Openeye Name: (4-chloro-2-cyclohexyl-phenyl) 1,3-dimethyl-2,4-dioxo-pyrimidine-5-sulfonate CAS Name: 1,3-dimethyl-2,4-dioxo-5-pyrimidinesulfonic acid (4-chloro-2-cyclohexylphenyl) ester IUPAC Name: (4-chloro-2-cyclohexylphenyl) 1,3-dimethyl-2,4-dioxopyrimidine-5-sulfonate Traditional Name: 2,4-diketo-1,3-dimethyl-pyrimidine-5-sulfonic acid (4-chloro-2-cyclohexyl-phenyl) ester Formula: C18H21ClN2O5S MolecularWeight: 412.88774

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)OC2=C(C=C(C=C2)Cl)C3CCCCC3

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)S(=O)(=O)OC2=C(C=C(C=C2)Cl)C3CCCCC3

InChI

InChI=1S/C18H21ClN2O5S/c1-20-11-16(17(22)21(2)18(20)23)27(24,25)26-15-9-8-13(19)10-14(15)12-6-4-3-5-7-12/h8-12H,3-7H2,1-2H3