3-cyanopropyl 3-(diethylsulfamoyl)-4-methyl-benzoate

Systemtic Name: 3-cyanopropyl 3-(diethylsulfamoyl)-4-methyl-benzoate Openeye Name: 3-cyanopropyl 3-(diethylsulfamoyl)-4-methyl-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methylbenzoic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-(diethylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methyl-benzoic acid 3-cyanopropyl ester Formula: C16H22N2O4S MolecularWeight: 338.42188

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCCCC#N)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OCCCC#N)C

InChI

InChI=1S/C16H22N2O4S/c1-4-18(5-2)23(20,21)15-12-14(9-8-13(15)3)16(19)22-11-7-6-10-17/h8-9,12H,4-7,11H2,1-3H3