[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-cyclohexylbenzoate

Systemtic Name: [2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl] 4-cyclohexylbenzoate Openeye Name: [2-(3-methylsulfonylanilino)-2-oxo-ethyl] 4-cyclohexylbenzoate CAS Name: 4-cyclohexylbenzoic acid [2-(3-methylsulfonylanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylsulfonylanilino)-2-oxoethyl] 4-cyclohexylbenzoate Traditional Name: 4-cyclohexylbenzoic acid [2-keto-2-(3-mesylanilino)ethyl] ester Formula: C22H25NO5S MolecularWeight: 415.5026

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3CCCCC3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)COC(=O)C2=CC=C(C=C2)C3CCCCC3

InChI

InChI=1S/C22H25NO5S/c1-29(26,27)20-9-5-8-19(14-20)23-21(24)15-28-22(25)18-12-10-17(11-13-18)16-6-3-2-4-7-16/h5,8-14,16H,2-4,6-7,15H2,1H3,(H,23,24)