(2-ethoxyphenyl) 3-[(3-fluorophenyl)carbamoyl]benzenesulfonate

Systemtic Name: (2-ethoxyphenyl) 3-[(3-fluorophenyl)carbamoyl]benzenesulfonate Openeye Name: (2-ethoxyphenyl) 3-[(3-fluorophenyl)carbamoyl]benzenesulfonate CAS Name: 3-[(3-fluoroanilino)-oxomethyl]benzenesulfonic acid (2-ethoxyphenyl) ester IUPAC Name: (2-ethoxyphenyl) 3-[(3-fluorophenyl)carbamoyl]benzenesulfonate Traditional Name: 3-[(3-fluorophenyl)carbamoyl]benzenesulfonic acid o-phenetyl ester Formula: C21H18FNO5S MolecularWeight: 415.434723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=CC=CC=C1OS(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C21H18FNO5S/c1-2-27-19-11-3-4-12-20(19)28-29(25,26)18-10-5-7-15(13-18)21(24)23-17-9-6-8-16(22)14-17/h3-14H,2H2,1H3,(H,23,24)