[(2R)-3-butoxy-2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-propyl] 4-chloranylbenzoate

Systemtic Name: [(2R)-3-butoxy-2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-oxidanylidene-propyl] 4-chloranylbenzoate Openeye Name: [(2R)-3-butoxy-2-methyl-3-oxo-2-(p-tolylsulfonylamino)propyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(2R)-3-butoxy-2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-oxopropyl] ester IUPAC Name: [(2R)-3-butoxy-2-methyl-2-[(4-methylphenyl)sulfonylamino]-3-oxopropyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(2R)-3-butoxy-3-keto-2-methyl-2-(tosylamino)propyl] ester Formula: C22H26ClNO6S MolecularWeight: 467.96294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C)(COC(=O)C1=CC=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCOC(=O)[C@@](C)(COC(=O)C1=CC=C(C=C1)Cl)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H26ClNO6S/c1-4-5-14-29-21(26)22(3,15-30-20(25)17-8-10-18(23)11-9-17)24-31(27,28)19-12-6-16(2)7-13-19/h6-13,24H,4-5,14-15H2,1-3H3/t22-/m1/s1