pyridin-3-yl 4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: pyridin-3-yl 4-fluoranyl-3-(4-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: 3-pyridyl 4-fluoro-3-[(4-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-fluoro-3-[(4-methyl-1-piperidinyl)sulfonyl]benzoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl 4-fluoro-3-(4-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-fluoro-3-(4-methylpiperidino)sulfonyl-benzoic acid 3-pyridyl ester Formula: C18H19FN2O4S MolecularWeight: 378.417863

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CN=CC=C3)F

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CN=CC=C3)F

InChI

InChI=1S/C18H19FN2O4S/c1-13-6-9-21(10-7-13)26(23,24)17-11-14(4-5-16(17)19)18(22)25-15-3-2-8-20-12-15/h2-5,8,11-13H,6-7,9-10H2,1H3