tert-butyl (2S)-2-(1-cyanoethenyl)-5,6-dimethoxy-3-oxidanylidene-1H-indene-2-carboxylate

Systemtic Name: tert-butyl (2S)-2-(1-cyanoethenyl)-5,6-dimethoxy-3-oxidanylidene-1H-indene-2-carboxylate Openeye Name: tert-butyl (2S)-2-(1-cyanovinyl)-5,6-dimethoxy-1-oxo-indane-2-carboxylate CAS Name: (2S)-2-(1-cyanoethenyl)-5,6-dimethoxy-3-oxo-1H-indene-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-(1-cyanoethenyl)-5,6-dimethoxy-3-oxo-1H-indene-2-carboxylate Traditional Name: (2S)-2-(1-cyanovinyl)-1-keto-5,6-dimethoxy-indane-2-carboxylic acid tert-butyl ester Formula: C19H21NO5 MolecularWeight: 343.37374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1(CC2=CC(=C(C=C2C1=O)OC)OC)C(=C)C#N

Isomeric SMILES

CC(C)(C)OC(=O)[C@@]1(CC2=CC(=C(C=C2C1=O)OC)OC)C(=C)C#N

InChI

InChI=1S/C19H21NO5/c1-11(10-20)19(17(22)25-18(2,3)4)9-12-7-14(23-5)15(24-6)8-13(12)16(19)21/h7-8H,1,9H2,2-6H3/t19-/m0/s1