[2-oxidanylidene-2-(propylamino)ethyl] 4-(2,5-dimethylphenyl)sulfonyloxybenzoate

Systemtic Name: [2-oxidanylidene-2-(propylamino)ethyl] 4-(2,5-dimethylphenyl)sulfonyloxybenzoate Openeye Name: [2-oxo-2-(propylamino)ethyl] 4-(2,5-dimethylphenyl)sulfonyloxybenzoate CAS Name: 4-(2,5-dimethylphenyl)sulfonyloxybenzoic acid [2-oxo-2-(propylamino)ethyl] ester IUPAC Name: [2-oxo-2-(propylamino)ethyl] 4-(2,5-dimethylphenyl)sulfonyloxybenzoate Traditional Name: 4-(2,5-dimethylphenyl)sulfonyloxybenzoic acid [2-keto-2-(propylamino)ethyl] ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)COC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCNC(=O)COC(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

InChI=1S/C20H23NO6S/c1-4-11-21-19(22)13-26-20(23)16-7-9-17(10-8-16)27-28(24,25)18-12-14(2)5-6-15(18)3/h5-10,12H,4,11,13H2,1-3H3,(H,21,22)