(1-methylpiperidin-4-yl) 2-oxidanyl-2-phenyl-pent-4-ynoate

Systemtic Name: (1-methylpiperidin-4-yl) 2-oxidanyl-2-phenyl-pent-4-ynoate Openeye Name: (1-methyl-4-piperidyl) 2-hydroxy-2-phenyl-pent-4-ynoate CAS Name: 2-hydroxy-2-phenyl-4-pentynoic acid (1-methyl-4-piperidinyl) ester IUPAC Name: (1-methylpiperidin-4-yl) 2-hydroxy-2-phenylpent-4-ynoate Traditional Name: 2-hydroxy-2-phenyl-pent-4-ynoic acid (1-methyl-4-piperidyl) ester Formula: C17H21NO3 MolecularWeight: 287.35354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)OC(=O)C(CC#C)(C2=CC=CC=C2)O

Isomeric SMILES

CN1CCC(CC1)OC(=O)C(CC#C)(C2=CC=CC=C2)O

InChI

InChI=1S/C17H21NO3/c1-3-11-17(20,14-7-5-4-6-8-14)16(19)21-15-9-12-18(2)13-10-15/h1,4-8,15,20H,9-13H2,2H3