(2-ethoxyphenyl) 3-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]carbamoyl]benzenesulfonate

Systemtic Name: (2-ethoxyphenyl) 3-[[2-oxidanylidene-2-(propan-2-ylamino)ethyl]carbamoyl]benzenesulfonate Openeye Name: (2-ethoxyphenyl) 3-[[2-(isopropylamino)-2-oxo-ethyl]carbamoyl]benzenesulfonate CAS Name: 3-[oxo-[[2-oxo-2-(propan-2-ylamino)ethyl]amino]methyl]benzenesulfonic acid (2-ethoxyphenyl) ester IUPAC Name: (2-ethoxyphenyl) 3-[[2-oxo-2-(propan-2-ylamino)ethyl]carbamoyl]benzenesulfonate Traditional Name: 3-[[2-(isopropylamino)-2-keto-ethyl]carbamoyl]benzenesulfonic acid o-phenetyl ester Formula: C20H24N2O6S MolecularWeight: 420.47936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(=O)NC(C)C

Isomeric SMILES

CCOC1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)C(=O)NCC(=O)NC(C)C

InChI

InChI=1S/C20H24N2O6S/c1-4-27-17-10-5-6-11-18(17)28-29(25,26)16-9-7-8-15(12-16)20(24)21-13-19(23)22-14(2)3/h5-12,14H,4,13H2,1-3H3,(H,21,24)(H,22,23)