ethyl 4-(4-fluorophenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carboxylate

Systemtic Name: ethyl 4-(4-fluorophenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carboxylate Openeye Name: ethyl 4-(4-fluorophenyl)sulfonyl-1-prop-2-ynyl-piperidine-4-carboxylate CAS Name: 4-(4-fluorophenyl)sulfonyl-1-prop-2-ynyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-fluorophenyl)sulfonyl-1-prop-2-ynylpiperidine-4-carboxylate Traditional Name: 4-(4-fluorophenyl)sulfonyl-1-propargyl-isonipecotic acid ethyl ester Formula: C17H20FNO4S MolecularWeight: 353.408403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CC#C)S(=O)(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CC#C)S(=O)(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C17H20FNO4S/c1-3-11-19-12-9-17(10-13-19,16(20)23-4-2)24(21,22)15-7-5-14(18)6-8-15/h1,5-8H,4,9-13H2,2H3