2,2-dimethyl-3-[1-(oxan-2-yloxy)ethyl]-3-phenoxy-non-4-ynoic acid

Systemtic Name: 2,2-dimethyl-3-[1-(oxan-2-yloxy)ethyl]-3-phenoxy-non-4-ynoic acid Openeye Name: 2,2-dimethyl-3-phenoxy-3-(1-tetrahydropyran-2-yloxyethyl)non-4-ynoic acid CAS Name: 2,2-dimethyl-3-[1-(2-oxanyloxy)ethyl]-3-phenoxy-4-nonynoic acid IUPAC Name: 2,2-dimethyl-3-[1-(oxan-2-yloxy)ethyl]-3-phenoxynon-4-ynoic acid Traditional Name: 2,2-dimethyl-3-phenoxy-3-(1-tetrahydropyran-2-yloxyethyl)non-4-ynoic acid Formula: C24H34O5 MolecularWeight: 402.52376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC(C(C)OC1CCCCO1)(C(C)(C)C(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CCCCC#CC(C(C)OC1CCCCO1)(C(C)(C)C(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C24H34O5/c1-5-6-7-12-17-24(23(3,4)22(25)26,29-20-14-9-8-10-15-20)19(2)28-21-16-11-13-18-27-21/h8-10,14-15,19,21H,5-7,11,13,16,18H2,1-4H3,(H,25,26)