[2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 4-chloranyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 3-(benzylsulfamoyl)-4-chloro-benzoate CAS Name: 4-chloro-3-[(phenylmethyl)sulfamoyl]benzoic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 3-(benzylsulfamoyl)-4-chlorobenzoate Traditional Name: 3-(benzylsulfamoyl)-4-chloro-benzoic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C28H35ClN2O5S MolecularWeight: 547.1059

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)N(C2CCCCC2)C(=O)COC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C28H35ClN2O5S/c29-25-17-16-22(18-26(25)37(34,35)30-19-21-10-4-1-5-11-21)28(33)36-20-27(32)31(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1,4-5,10-11,16-18,23-24,30H,2-3,6-9,12-15,19-20H2