sodium 2-[(4-fluorophenyl)-propan-2-yl-amino]-2-oxidanylidene-ethanesulfonate

Systemtic Name: sodium 2-[(4-fluorophenyl)-propan-2-yl-amino]-2-oxidanylidene-ethanesulfonate Openeye Name: sodium 2-(4-fluoro-N-isopropyl-anilino)-2-oxo-ethanesulfonate CAS Name: sodium 2-(4-fluoro-N-propan-2-ylanilino)-2-oxoethanesulfonate IUPAC Name: sodium 2-(4-fluoro-N-propan-2-ylanilino)-2-oxoethanesulfonate Traditional Name: sodium 2-(4-fluoro-N-isopropyl-anilino)-2-keto-ethanesulfonate Formula: C11H13FNNaO4S MolecularWeight: 297.278393

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C1=CC=C(C=C1)F)C(=O)CS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)N(C1=CC=C(C=C1)F)C(=O)CS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H14FNO4S.Na/c1-8(2)13(11(14)7-18(15,16)17)10-5-3-9(12)4-6-10;/h3-6,8H,7H2,1-2H3,(H,15,16,17);/q;+1/p-1