methyl 2-[[(1S)-1-cyano-1,2-dimethoxy-2-oxidanylidene-ethyl]carbamoyl]benzoate

Systemtic Name: methyl 2-[[(1S)-1-cyano-1,2-dimethoxy-2-oxidanylidene-ethyl]carbamoyl]benzoate Openeye Name: methyl 2-[[(1S)-1-cyano-1,2-dimethoxy-2-oxo-ethyl]carbamoyl]benzoate CAS Name: 2-[[[(1S)-1-cyano-1,2-dimethoxy-2-oxoethyl]amino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 2-[[(1S)-1-cyano-1,2-dimethoxy-2-oxoethyl]carbamoyl]benzoate Traditional Name: 2-[[(1S)-1-cyano-2-keto-1,2-dimethoxy-ethyl]carbamoyl]benzoic acid methyl ester Formula: C14H14N2O6 MolecularWeight: 306.27076

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)NC(C#N)(C(=O)OC)OC

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)N[C@](C#N)(C(=O)OC)OC

InChI

InChI=1S/C14H14N2O6/c1-20-12(18)10-7-5-4-6-9(10)11(17)16-14(8-15,22-3)13(19)21-2/h4-7H,1-3H3,(H,16,17)/t14-/m0/s1