(3S)-3,4-bis(oxidanyl)-6-phenyl-hex-5-ynoic acid

Systemtic Name: (3S)-3,4-bis(oxidanyl)-6-phenyl-hex-5-ynoic acid Openeye Name: (3S)-3,4-dihydroxy-6-phenyl-hex-5-ynoic acid CAS Name: (3S)-3,4-dihydroxy-6-phenyl-5-hexynoic acid IUPAC Name: (3S)-3,4-dihydroxy-6-phenylhex-5-ynoic acid Traditional Name: (3S)-3,4-dihydroxy-6-phenyl-hex-5-ynoic acid Formula: C12H12O4 MolecularWeight: 220.22128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O4/c13-10(11(14)8-12(15)16)7-6-9-4-2-1-3-5-9/h1-5,10-11,13-14H,8H2,(H,15,16)/t10?,11-/m0/s1