methyl 3-(2-cyano-2-methylsulfonyl-ethenyl)-1H-indole-2-carboxylate

Systemtic Name: methyl 3-(2-cyano-2-methylsulfonyl-ethenyl)-1H-indole-2-carboxylate Openeye Name: methyl 3-(2-cyano-2-methylsulfonyl-vinyl)-1H-indole-2-carboxylate CAS Name: 3-(2-cyano-2-methylsulfonylethenyl)-1H-indole-2-carboxylic acid methyl ester IUPAC Name: methyl 3-(2-cyano-2-methylsulfonylethenyl)-1H-indole-2-carboxylate Traditional Name: 3-(2-cyano-2-mesyl-vinyl)-1H-indole-2-carboxylic acid methyl ester Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=CC=CC=C2N1)C=C(C#N)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=C(C2=CC=CC=C2N1)C=C(C#N)S(=O)(=O)C

InChI

InChI=1S/C14H12N2O4S/c1-20-14(17)13-11(7-9(8-15)21(2,18)19)10-5-3-4-6-12(10)16-13/h3-7,16H,1-2H3