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

Systemtic Name: phenacyl 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: phenacyl 3-(benzylsulfamoyl)-4-chloro-benzoate CAS Name: 4-chloro-3-[(phenylmethyl)sulfamoyl]benzoic acid phenacyl ester IUPAC Name: phenacyl 3-(benzylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(benzylsulfamoyl)-4-chloro-benzoic acid phenacyl ester Formula: C22H18ClNO5S MolecularWeight: 443.90002

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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)OCC(=O)C3=CC=CC=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNS(=O)(=O)C2=C(C=CC(=C2)C(=O)OCC(=O)C3=CC=CC=C3)Cl

InChI

InChI=1S/C22H18ClNO5S/c23-19-12-11-18(22(26)29-15-20(25)17-9-5-2-6-10-17)13-21(19)30(27,28)24-14-16-7-3-1-4-8-16/h1-13,24H,14-15H2