trimethyl (2R,3S)-3-(2-chlorophenyl)-2-cyano-cyclopropane-1,1,2-tricarboxylate

Systemtic Name: trimethyl (2R,3S)-3-(2-chlorophenyl)-2-cyano-cyclopropane-1,1,2-tricarboxylate Openeye Name: trimethyl (2R,3S)-3-(2-chlorophenyl)-2-cyano-cyclopropane-1,1,2-tricarboxylate CAS Name: (2R,3S)-3-(2-chlorophenyl)-2-cyanocyclopropane-1,1,2-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (2R,3S)-3-(2-chlorophenyl)-2-cyanocyclopropane-1,1,2-tricarboxylate Traditional Name: (2R,3S)-3-(2-chlorophenyl)-2-cyano-cyclopropane-1,1,2-tricarboxylic acid trimethyl ester Formula: C16H14ClNO6 MolecularWeight: 351.73846

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(C(C1(C(=O)OC)C(=O)OC)C2=CC=CC=C2Cl)C#N

Isomeric SMILES

COC(=O)[C@@]1([C@@H](C1(C(=O)OC)C(=O)OC)C2=CC=CC=C2Cl)C#N

InChI

InChI=1S/C16H14ClNO6/c1-22-12(19)15(8-18)11(9-6-4-5-7-10(9)17)16(15,13(20)23-2)14(21)24-3/h4-7,11H,1-3H3/t11-,15-/m0/s1