(1-methylpiperidin-4-yl) 5-methyl-2-oxidanyl-2-phenyl-hex-3-ynoate

Systemtic Name: (1-methylpiperidin-4-yl) 5-methyl-2-oxidanyl-2-phenyl-hex-3-ynoate Openeye Name: (1-methyl-4-piperidyl) 2-hydroxy-5-methyl-2-phenyl-hex-3-ynoate CAS Name: 2-hydroxy-5-methyl-2-phenyl-3-hexynoic acid (1-methyl-4-piperidinyl) ester IUPAC Name: (1-methylpiperidin-4-yl) 2-hydroxy-5-methyl-2-phenylhex-3-ynoate Traditional Name: 2-hydroxy-5-methyl-2-phenyl-hex-3-ynoic acid (1-methyl-4-piperidyl) ester Formula: C19H25NO3 MolecularWeight: 315.4067

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC(C1=CC=CC=C1)(C(=O)OC2CCN(CC2)C)O

Isomeric SMILES

CC(C)C#CC(C1=CC=CC=C1)(C(=O)OC2CCN(CC2)C)O

InChI

InChI=1S/C19H25NO3/c1-15(2)9-12-19(22,16-7-5-4-6-8-16)18(21)23-17-10-13-20(3)14-11-17/h4-8,15,17,22H,10-11,13-14H2,1-3H3