methyl 2-[(E)-1-oxidanylidenehexadec-3-en-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[(E)-1-oxidanylidenehexadec-3-en-2-yl]sulfanylethanoate Openeye Name: methyl 2-[(E)-1-formylpentadec-2-enyl]sulfanylacetate CAS Name: 2-[[(E)-1-oxohexadec-3-en-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[(E)-1-oxohexadec-3-en-2-yl]sulfanylacetate Traditional Name: 2-[[(E)-1-formylpentadec-2-enyl]thio]acetic acid methyl ester Formula: C19H34O3S MolecularWeight: 342.53646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC=CC(C=O)SCC(=O)OC

Isomeric SMILES

CCCCCCCCCCCC/C=C/C(C=O)SCC(=O)OC

InChI

InChI=1S/C19H34O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(16-20)23-17-19(21)22-2/h14-16,18H,3-13,17H2,1-2H3/b15-14+