methyl 2-[(E)-cyano-[(5E)-5-propylsulfonyloxyiminothiophen-2-ylidene]methyl]benzoate

Systemtic Name: methyl 2-[(E)-cyano-[(5E)-5-propylsulfonyloxyiminothiophen-2-ylidene]methyl]benzoate Openeye Name: methyl 2-[(E)-cyano-[(5E)-5-propylsulfonyloxyimino-2-thienylidene]methyl]benzoate CAS Name: 2-[(E)-cyano-[(5E)-5-propylsulfonyloxyimino-2-thiophenylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-[(E)-cyano-[(5E)-5-propylsulfonyloxyiminothiophen-2-ylidene]methyl]benzoate Traditional Name: 2-[(E)-cyano-[(5E)-5-propylsulfonyloximino-2-thienylidene]methyl]benzoic acid methyl ester Formula: C17H16N2O5S2 MolecularWeight: 392.44934

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)ON=C1C=CC(=C(C#N)C2=CC=CC=C2C(=O)OC)S1

Isomeric SMILES

CCCS(=O)(=O)O/N=C/1\C=C/C(=C(\C#N)/C2=CC=CC=C2C(=O)OC)/S1

InChI

InChI=1S/C17H16N2O5S2/c1-3-10-26(21,22)24-19-16-9-8-15(25-16)14(11-18)12-6-4-5-7-13(12)17(20)23-2/h4-9H,3,10H2,1-2H3/b15-14-,19-16+