3-cyanopropyl 4-(prop-2-ynylsulfamoyl)benzoate

Systemtic Name: 3-cyanopropyl 4-(prop-2-ynylsulfamoyl)benzoate Openeye Name: 3-cyanopropyl 4-(prop-2-ynylsulfamoyl)benzoate CAS Name: 4-(prop-2-ynylsulfamoyl)benzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 4-(prop-2-ynylsulfamoyl)benzoate Traditional Name: 4-(propargylsulfamoyl)benzoic acid 3-cyanopropyl ester Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCCCC#N

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)OCCCC#N

InChI

InChI=1S/C14H14N2O4S/c1-2-10-16-21(18,19)13-7-5-12(6-8-13)14(17)20-11-4-3-9-15/h1,5-8,16H,3-4,10-11H2