methyl 4-[(2E)-2-(1-cyano-2-oxidanylidene-2-propoxy-ethylidene)hydrazinyl]-2-sulfamoyl-benzoate

Systemtic Name: methyl 4-[(2E)-2-(1-cyano-2-oxidanylidene-2-propoxy-ethylidene)hydrazinyl]-2-sulfamoyl-benzoate Openeye Name: methyl 4-[(2E)-2-(1-cyano-2-oxo-2-propoxy-ethylidene)hydrazino]-2-sulfamoyl-benzoate CAS Name: 4-[(2E)-2-(1-cyano-2-oxo-2-propoxyethylidene)hydrazinyl]-2-sulfamoylbenzoic acid methyl ester IUPAC Name: methyl 4-[(2E)-2-(1-cyano-2-oxo-2-propoxyethylidene)hydrazinyl]-2-sulfamoylbenzoate Traditional Name: 4-[(N'E)-N'-(1-cyano-2-keto-2-propoxy-ethylidene)hydrazino]-2-sulfamoyl-benzoic acid methyl ester Formula: C14H16N4O6S MolecularWeight: 368.36504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(=NNC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N)C#N

Isomeric SMILES

CCCOC(=O)/C(=N/NC1=CC(=C(C=C1)C(=O)OC)S(=O)(=O)N)/C#N

InChI

InChI=1S/C14H16N4O6S/c1-3-6-24-14(20)11(8-15)18-17-9-4-5-10(13(19)23-2)12(7-9)25(16,21)22/h4-5,7,17H,3,6H2,1-2H3,(H2,16,21,22)/b18-11+