9-[5-[(E)-3-oxidanylideneoct-1-enyl]thiophen-2-yl]nonanoic acid

Systemtic Name: 9-[5-[(E)-3-oxidanylideneoct-1-enyl]thiophen-2-yl]nonanoic acid Openeye Name: 9-[5-[(E)-3-oxooct-1-enyl]-2-thienyl]nonanoic acid CAS Name: 9-[5-[(E)-3-oxooct-1-enyl]-2-thiophenyl]nonanoic acid IUPAC Name: 9-[5-[(E)-3-oxooct-1-enyl]thiophen-2-yl]nonanoic acid Traditional Name: 9-[5-[(E)-3-ketooct-1-enyl]-2-thienyl]pelargonic acid Formula: C21H32O3S MolecularWeight: 364.54198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C=CC1=CC=C(S1)CCCCCCCCC(=O)O

Isomeric SMILES

CCCCCC(=O)/C=C/C1=CC=C(S1)CCCCCCCCC(=O)O

InChI

InChI=1S/C21H32O3S/c1-2-3-8-11-18(22)14-15-20-17-16-19(25-20)12-9-6-4-5-7-10-13-21(23)24/h14-17H,2-13H2,1H3,(H,23,24)/b15-14+