ethyl 2-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl]sulfanylethanoate

Systemtic Name: ethyl 2-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl]sulfanylethanoate Openeye Name: ethyl 2-[(E)-3-(octylamino)-3-oxo-prop-1-enyl]sulfanylacetate CAS Name: 2-[[(E)-3-(octylamino)-3-oxoprop-1-enyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(E)-3-(octylamino)-3-oxoprop-1-enyl]sulfanylacetate Traditional Name: 2-[[(E)-3-keto-3-(octylamino)prop-1-enyl]thio]acetic acid ethyl ester Formula: C15H27NO3S MolecularWeight: 301.44478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSCC(=O)OCC

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SCC(=O)OCC

InChI

InChI=1S/C15H27NO3S/c1-3-5-6-7-8-9-11-16-14(17)10-12-20-13-15(18)19-4-2/h10,12H,3-9,11,13H2,1-2H3,(H,16,17)/b12-10+