S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] (E)-oct-2-enethioate

Systemtic Name: S-[(E)-3-(octylamino)-3-oxidanylidene-prop-1-enyl] (E)-oct-2-enethioate Openeye Name: S-[(E)-3-(octylamino)-3-oxo-prop-1-enyl] (E)-oct-2-enethioate CAS Name: (E)-2-octenethioic acid S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] ester IUPAC Name: S-[(E)-3-(octylamino)-3-oxoprop-1-enyl] (E)-oct-2-enethioate Traditional Name: (E)-oct-2-enethioic acid S-[(E)-3-keto-3-(octylamino)prop-1-enyl] ester Formula: C19H33NO2S MolecularWeight: 339.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C=CSC(=O)C=CCCCCC

Isomeric SMILES

CCCCCCCCNC(=O)/C=C/SC(=O)/C=C/CCCCC

InChI

InChI=1S/C19H33NO2S/c1-3-5-7-9-11-13-16-20-18(21)15-17-23-19(22)14-12-10-8-6-4-2/h12,14-15,17H,3-11,13,16H2,1-2H3,(H,20,21)/b14-12+,17-15+