4-[5-[(E)-3-oxidanylideneoct-1-enyl]thiophen-2-yl]butanoic acid

Systemtic Name: 4-[5-[(E)-3-oxidanylideneoct-1-enyl]thiophen-2-yl]butanoic acid Openeye Name: 4-[5-[(E)-3-oxooct-1-enyl]-2-thienyl]butanoic acid CAS Name: 4-[5-[(E)-3-oxooct-1-enyl]-2-thiophenyl]butanoic acid IUPAC Name: 4-[5-[(E)-3-oxooct-1-enyl]thiophen-2-yl]butanoic acid Traditional Name: 4-[5-[(E)-3-ketooct-1-enyl]-2-thienyl]butyric acid Formula: C16H22O3S MolecularWeight: 294.40908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H22O3S/c1-2-3-4-6-13(17)9-10-15-12-11-14(20-15)7-5-8-16(18)19/h9-12H,2-8H2,1H3,(H,18,19)/b10-9+