[2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] 4-butoxybenzoate

Systemtic Name: [2-[4-(methylsulfonylamino)phenyl]-2-oxidanylidene-ethyl] 4-butoxybenzoate Openeye Name: [2-[4-(methanesulfonamido)phenyl]-2-oxo-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [2-[4-(methanesulfonamido)phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(methanesulfonamido)phenyl]-2-oxoethyl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-keto-2-[4-(methanesulfonamido)phenyl]ethyl] ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

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