[2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-(diethylsulfamoyl)benzoate

Systemtic Name: [2-(6-methylheptan-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-(diethylsulfamoyl)benzoate Openeye Name: [2-(1,5-dimethylhexylamino)-2-oxo-ethyl] 2-chloro-5-(diethylsulfamoyl)benzoate CAS Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [2-(6-methylheptan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(6-methylheptan-2-ylamino)-2-oxoethyl] 2-chloro-5-(diethylsulfamoyl)benzoate Traditional Name: 2-chloro-5-(diethylsulfamoyl)benzoic acid [2-(1,5-dimethylhexylamino)-2-keto-ethyl] ester Formula: C21H33ClN2O5S MolecularWeight: 461.01512

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC(C)CCCC(C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)Cl)C(=O)OCC(=O)NC(C)CCCC(C)C

InChI

InChI=1S/C21H33ClN2O5S/c1-6-24(7-2)30(27,28)17-11-12-19(22)18(13-17)21(26)29-14-20(25)23-16(5)10-8-9-15(3)4/h11-13,15-16H,6-10,14H2,1-5H3,(H,23,25)