3-[2-(4-fluorophenyl)ethylamino]-2-methyl-3-oxidanylidene-propane-1-sulfinic acid

Systemtic Name: 3-[2-(4-fluorophenyl)ethylamino]-2-methyl-3-oxidanylidene-propane-1-sulfinic acid Openeye Name: 3-[2-(4-fluorophenyl)ethylamino]-2-methyl-3-oxo-propane-1-sulfinic acid CAS Name: 3-[2-(4-fluorophenyl)ethylamino]-2-methyl-3-oxo-1-propanesulfinic acid IUPAC Name: 3-[2-(4-fluorophenyl)ethylamino]-2-methyl-3-oxopropane-1-sulfinic acid Traditional Name: 3-[2-(4-fluorophenyl)ethylamino]-3-keto-2-methyl-propane-1-sulfinic acid Formula: C12H16FNO3S MolecularWeight: 273.323743

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS(=O)O)C(=O)NCCC1=CC=C(C=C1)F

Isomeric SMILES

CC(CS(=O)O)C(=O)NCCC1=CC=C(C=C1)F

InChI

InChI=1S/C12H16FNO3S/c1-9(8-18(16)17)12(15)14-7-6-10-2-4-11(13)5-3-10/h2-5,9H,6-8H2,1H3,(H,14,15)(H,16,17)