3-(4-piperidin-1-ylsulfinyloxyphenyl)prop-2-ynoic acid

Systemtic Name: 3-(4-piperidin-1-ylsulfinyloxyphenyl)prop-2-ynoic acid Openeye Name: 3-[4-(1-piperidylsulfinyloxy)phenyl]prop-2-ynoic acid CAS Name: 3-[4-(1-piperidinylsulfinyloxy)phenyl]-2-propynoic acid IUPAC Name: 3-(4-piperidin-1-ylsulfinyloxyphenyl)prop-2-ynoic acid Traditional Name: 3-(4-piperidinosulfinyloxyphenyl)propiolic acid Formula: C14H15NO4S MolecularWeight: 293.3382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)OC2=CC=C(C=C2)C#CC(=O)O

Isomeric SMILES

C1CCN(CC1)S(=O)OC2=CC=C(C=C2)C#CC(=O)O

InChI

InChI=1S/C14H15NO4S/c16-14(17)9-6-12-4-7-13(8-5-12)19-20(18)15-10-2-1-3-11-15/h4-5,7-8H,1-3,10-11H2,(H,16,17)