methyl (2S)-2-oxidanyl-2,7-diphenyl-hept-3-ynoate

Systemtic Name: methyl (2S)-2-oxidanyl-2,7-diphenyl-hept-3-ynoate Openeye Name: methyl (2S)-2-hydroxy-2,7-diphenyl-hept-3-ynoate CAS Name: (2S)-2-hydroxy-2,7-diphenyl-3-heptynoic acid methyl ester IUPAC Name: methyl (2S)-2-hydroxy-2,7-diphenylhept-3-ynoate Traditional Name: (2S)-2-hydroxy-2,7-diphenyl-hept-3-ynoic acid methyl ester Formula: C20H20O3 MolecularWeight: 308.371

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C#CCCCC1=CC=CC=C1)(C2=CC=CC=C2)O

Isomeric SMILES

COC(=O)[C@@](C#CCCCC1=CC=CC=C1)(C2=CC=CC=C2)O

InChI

InChI=1S/C20H20O3/c1-23-19(21)20(22,18-14-8-3-9-15-18)16-10-4-7-13-17-11-5-2-6-12-17/h2-3,5-6,8-9,11-12,14-15,22H,4,7,13H2,1H3/t20-/m1/s1