2-[1-(oxan-2-yloxy)but-3-ynyl]-2-phenyl-oct-3-ynoic acid

Systemtic Name: 2-[1-(oxan-2-yloxy)but-3-ynyl]-2-phenyl-oct-3-ynoic acid Openeye Name: 2-phenyl-2-(1-tetrahydropyran-2-yloxybut-3-ynyl)oct-3-ynoic acid CAS Name: 2-[1-(2-oxanyloxy)but-3-ynyl]-2-phenyl-3-octynoic acid IUPAC Name: 2-[1-(oxan-2-yloxy)but-3-ynyl]-2-phenyloct-3-ynoic acid Traditional Name: 2-phenyl-2-(1-tetrahydropyran-2-yloxybut-3-ynyl)oct-3-ynoic acid Formula: C23H28O4 MolecularWeight: 368.46602

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C1=CC=CC=C1)(C(CC#C)OC2CCCCO2)C(=O)O

Isomeric SMILES

CCCCC#CC(C1=CC=CC=C1)(C(CC#C)OC2CCCCO2)C(=O)O

InChI

InChI=1S/C23H28O4/c1-3-5-6-11-17-23(22(24)25,19-14-8-7-9-15-19)20(13-4-2)27-21-16-10-12-18-26-21/h2,7-9,14-15,20-21H,3,5-6,10,12-13,16,18H2,1H3,(H,24,25)