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

Systemtic Name: [2-[4-[2-(methylsulfonylamino)ethyl]phenyl]-2-oxidanylidene-ethyl] 4-propoxybenzoate Openeye Name: [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxo-ethyl] 4-propoxybenzoate CAS Name: 4-propoxybenzoic acid [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxoethyl] ester IUPAC Name: [2-[4-[2-(methanesulfonamido)ethyl]phenyl]-2-oxoethyl] 4-propoxybenzoate Traditional Name: 4-propoxybenzoic acid [2-keto-2-[4-[2-(methanesulfonamido)ethyl]phenyl]ethyl] ester Formula: C21H25NO6S MolecularWeight: 419.4913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)CCNS(=O)(=O)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=C(C=C2)CCNS(=O)(=O)C

InChI

InChI=1S/C21H25NO6S/c1-3-14-27-19-10-8-18(9-11-19)21(24)28-15-20(23)17-6-4-16(5-7-17)12-13-22-29(2,25)26/h4-11,22H,3,12-15H2,1-2H3