(4-methylpiperidin-4-yl) 2-oxidanyl-2-prop-2-ynyl-heptanoate

Systemtic Name: (4-methylpiperidin-4-yl) 2-oxidanyl-2-prop-2-ynyl-heptanoate Openeye Name: (4-methyl-4-piperidyl) 2-hydroxy-2-prop-2-ynyl-heptanoate CAS Name: 2-hydroxy-2-prop-2-ynylheptanoic acid (4-methyl-4-piperidinyl) ester IUPAC Name: (4-methylpiperidin-4-yl) 2-hydroxy-2-prop-2-ynylheptanoate Traditional Name: 2-amyl-2-hydroxy-pent-4-ynoic acid (4-methyl-4-piperidyl) ester Formula: C16H27NO3 MolecularWeight: 281.39048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC#C)(C(=O)OC1(CCNCC1)C)O

Isomeric SMILES

CCCCCC(CC#C)(C(=O)OC1(CCNCC1)C)O

InChI

InChI=1S/C16H27NO3/c1-4-6-7-9-16(19,8-5-2)14(18)20-15(3)10-12-17-13-11-15/h2,17,19H,4,6-13H2,1,3H3