2-pentadeca-2,5,8-triynylsulfanylethanoic acid

Systemtic Name: 2-pentadeca-2,5,8-triynylsulfanylethanoic acid Openeye Name: 2-pentadeca-2,5,8-triynylsulfanylacetic acid CAS Name: 2-(pentadeca-2,5,8-triynylthio)acetic acid IUPAC Name: 2-pentadeca-2,5,8-triynylsulfanylacetic acid Traditional Name: 2-(pentadeca-2,5,8-triynylthio)acetic acid Formula: C17H22O2S MolecularWeight: 290.42038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC#CCC#CCC#CCSCC(=O)O

Isomeric SMILES

CCCCCCC#CCC#CCC#CCSCC(=O)O

InChI

InChI=1S/C17H22O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-17(18)19/h2-6,9,12,15-16H2,1H3,(H,18,19)