N-ethyl-N-[3-(6-fluoranyl-4-sulfonyl-cyclohexa-1,5-dien-1-yl)propyl]aniline

Systemtic Name: N-ethyl-N-[3-(6-fluoranyl-4-sulfonyl-cyclohexa-1,5-dien-1-yl)propyl]aniline Openeye Name: N-ethyl-N-[3-(6-fluoro-4-sulfonyl-cyclohexa-1,5-dien-1-yl)propyl]aniline CAS Name: N-ethyl-N-[3-(6-fluoro-4-sulfonyl-1-cyclohexa-1,5-dienyl)propyl]aniline IUPAC Name: N-ethyl-N-[3-(6-fluoro-4-sulfonylcyclohexa-1,5-dien-1-yl)propyl]aniline Traditional Name: ethyl-[3-(6-fluoro-4-sulfonyl-cyclohexa-1,5-dien-1-yl)propyl]-phenyl-amine Formula: C17H20FNO2S MolecularWeight: 321.409603

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CCCC1=CCC(=S(=O)=O)C=C1F)C2=CC=CC=C2

Isomeric SMILES

CCN(CCCC1=CCC(=S(=O)=O)C=C1F)C2=CC=CC=C2

InChI

InChI=1S/C17H20FNO2S/c1-2-19(15-8-4-3-5-9-15)12-6-7-14-10-11-16(22(20)21)13-17(14)18/h3-5,8-10,13H,2,6-7,11-12H2,1H3