methyl 2-[(3S)-1-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]piperidin-3-yl]ethanoate

Systemtic Name: methyl 2-[(3S)-1-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]piperidin-3-yl]ethanoate Openeye Name: methyl 2-[(3S)-1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-piperidyl]acetate CAS Name: 2-[(3S)-1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S)-1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]piperidin-3-yl]acetate Traditional Name: 2-[(3S)-1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-piperidyl]acetic acid methyl ester Formula: C17H22FNO4 MolecularWeight: 323.359283

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCCN(C1)CC2=C3C(=CC(=C2)F)COCO3

Isomeric SMILES

COC(=O)C[C@@H]1CCCN(C1)CC2=C3C(=CC(=C2)F)COCO3

InChI

InChI=1S/C17H22FNO4/c1-21-16(20)5-12-3-2-4-19(8-12)9-13-6-15(18)7-14-10-22-11-23-17(13)14/h6-7,12H,2-5,8-11H2,1H3/t12-/m0/s1