methyl 2-[2-cyano-1-phenyl-2-(phenylsulfonyl)ethyl]but-3-enoate

Systemtic Name: methyl 2-[2-cyano-1-phenyl-2-(phenylsulfonyl)ethyl]but-3-enoate Openeye Name: methyl 2-[2-(benzenesulfonyl)-2-cyano-1-phenyl-ethyl]but-3-enoate CAS Name: 2-[2-(benzenesulfonyl)-2-cyano-1-phenylethyl]-3-butenoic acid methyl ester IUPAC Name: methyl 2-[2-(benzenesulfonyl)-2-cyano-1-phenylethyl]but-3-enoate Traditional Name: 2-(2-besyl-2-cyano-1-phenyl-ethyl)but-3-enoic acid methyl ester Formula: C20H19NO4S MolecularWeight: 369.43416

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C=C)C(C1=CC=CC=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C=C)C(C1=CC=CC=C1)C(C#N)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C20H19NO4S/c1-3-17(20(22)25-2)19(15-10-6-4-7-11-15)18(14-21)26(23,24)16-12-8-5-9-13-16/h3-13,17-19H,1H2,2H3