ethyl (2R,3S)-2-methyl-3-phenyl-hex-5-ynoate

Systemtic Name: ethyl (2R,3S)-2-methyl-3-phenyl-hex-5-ynoate Openeye Name: ethyl (2R,3S)-2-methyl-3-phenyl-hex-5-ynoate CAS Name: (2R,3S)-2-methyl-3-phenyl-5-hexynoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-2-methyl-3-phenylhex-5-ynoate Traditional Name: (2R,3S)-2-methyl-3-phenyl-hex-5-ynoic acid ethyl ester Formula: C15H18O2 MolecularWeight: 230.30222

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)C(CC#C)C1=CC=CC=C1

Isomeric SMILES

CCOC(=O)[C@H](C)[C@H](CC#C)C1=CC=CC=C1

InChI

InChI=1S/C15H18O2/c1-4-9-14(12(3)15(16)17-5-2)13-10-7-6-8-11-13/h1,6-8,10-12,14H,5,9H2,2-3H3/t12-,14+/m1/s1