methyl 3-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 3-[2-[[(2R)-2-cyano-3-methyl-butan-2-yl]amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 3-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-oxo-ethoxy]benzoate CAS Name: 3-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 3-[2-[[(2R)-2-cyano-3-methylbutan-2-yl]amino]-2-oxoethoxy]benzoate Traditional Name: 3-[2-[[(1R)-1-cyano-1,2-dimethyl-propyl]amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C16H20N2O4 MolecularWeight: 304.341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)COC1=CC=CC(=C1)C(=O)OC

Isomeric SMILES

CC(C)[C@](C)(C#N)NC(=O)COC1=CC=CC(=C1)C(=O)OC

InChI

InChI=1S/C16H20N2O4/c1-11(2)16(3,10-17)18-14(19)9-22-13-7-5-6-12(8-13)15(20)21-4/h5-8,11H,9H2,1-4H3,(H,18,19)/t16-/m0/s1