tert-butyl (Z,2R)-2-cyano-5-oxidanylidene-2-phenyl-5-thiophen-2-yl-pent-3-enoate

Systemtic Name: tert-butyl (Z,2R)-2-cyano-5-oxidanylidene-2-phenyl-5-thiophen-2-yl-pent-3-enoate Openeye Name: tert-butyl (Z,2R)-2-cyano-5-oxo-2-phenyl-5-(2-thienyl)pent-3-enoate CAS Name: (Z,2R)-2-cyano-5-oxo-2-phenyl-5-thiophen-2-yl-3-pentenoic acid tert-butyl ester IUPAC Name: tert-butyl (Z,2R)-2-cyano-5-oxo-2-phenyl-5-thiophen-2-ylpent-3-enoate Traditional Name: (Z,2R)-2-cyano-5-keto-2-phenyl-5-(2-thienyl)pent-3-enoic acid tert-butyl ester Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(C=CC(=O)C1=CC=CS1)(C#N)C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)[C@@](/C=C\C(=O)C1=CC=CS1)(C#N)C2=CC=CC=C2

InChI

InChI=1S/C20H19NO3S/c1-19(2,3)24-18(23)20(14-21,15-8-5-4-6-9-15)12-11-16(22)17-10-7-13-25-17/h4-13H,1-3H3/b12-11-/t20-/m0/s1