(E)-3-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methylpiperidin-1-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(6-fluoranyl-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methylpiperidin-1-yl]prop-2-en-1-one Openeye Name: (E)-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methyl-1-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methyl-1-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methylpiperidin-1-yl]prop-2-en-1-one Traditional Name: (E)-3-(6-fluoro-4H-1,3-benzodioxin-8-yl)-1-[(2S)-2-methylpiperidino]prop-2-en-1-one Formula: C17H20FNO3 MolecularWeight: 305.344003

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C(=O)C=CC2=CC(=CC3=C2OCOC3)F

Isomeric SMILES

C[C@H]1CCCCN1C(=O)/C=C/C2=CC(=CC3=C2OCOC3)F

InChI

InChI=1S/C17H20FNO3/c1-12-4-2-3-7-19(12)16(20)6-5-13-8-15(18)9-14-10-21-11-22-17(13)14/h5-6,8-9,12H,2-4,7,10-11H2,1H3/b6-5+/t12-/m0/s1