(1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 5-methyl-2-oxidanyl-2-phenyl-hex-5-en-3-ynoate

Systemtic Name: (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 5-methyl-2-oxidanyl-2-phenyl-hex-5-en-3-ynoate Openeye Name: (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 2-hydroxy-5-methyl-2-phenyl-hex-5-en-3-ynoate CAS Name: 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoic acid (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl ester IUPAC Name: (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl 2-hydroxy-5-methyl-2-phenylhex-5-en-3-ynoate Traditional Name: 2-hydroxy-5-methyl-2-phenyl-hex-5-en-3-ynoic acid (1-methyl-3,6-dihydro-2H-pyridin-4-yl)methyl ester Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C#CC(C1=CC=CC=C1)(C(=O)OCC2=CCN(CC2)C)O

Isomeric SMILES

CC(=C)C#CC(C1=CC=CC=C1)(C(=O)OCC2=CCN(CC2)C)O

InChI

InChI=1S/C20H23NO3/c1-16(2)9-12-20(23,18-7-5-4-6-8-18)19(22)24-15-17-10-13-21(3)14-11-17/h4-8,10,23H,1,11,13-15H2,2-3H3