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3-cyanopropyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate

3-cyanopropyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name:3-cyanopropyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate
Openeye Name:3-cyanopropyl 3-(benzylsulfamoyl)-4-chloro-benzoate
CAS Name:4-chloro-3-[(phenylmethyl)sulfamoyl]benzoic acid 3-cyanopropyl ester
IUPAC Name:3-cyanopropyl 3-(benzylsulfamoyl)-4-chlorobenzoate
Traditional Name:3-(benzylsulfamoyl)-4-chloro-benzoic acid 3-cyanopropyl ester
Formula: C18H17ClN2O4S
MolecularWeight: 392.85658
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC#N)Cl


Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCCCC#N)Cl


InChI

InChI=1S/C18H17ClN2O4S/c19-16-9-8-15(18(22)25-11-5-4-10-20)12-17(16)26(23,24)21-13-14-6-2-1-3-7-14/h1-3,6-9,12,21H,4-5,11,13H2


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