ethyl (7E)-7-[3-(dimethylcarbamothioyloxy)-5-[(E)-oct-1-enyl]-2-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate

Systemtic Name: ethyl (7E)-7-[3-(dimethylcarbamothioyloxy)-5-[(E)-oct-1-enyl]-2-oxidanylidene-cyclopent-3-en-1-ylidene]heptanoate Openeye Name: ethyl (7E)-7-[3-(dimethylcarbamothioyloxy)-5-[(E)-oct-1-enyl]-2-oxo-cyclopent-3-en-1-ylidene]heptanoate CAS Name: (7E)-7-[3-[dimethylamino(sulfanylidene)methoxy]-5-[(E)-oct-1-enyl]-2-oxo-1-cyclopent-3-enylidene]heptanoic acid ethyl ester IUPAC Name: ethyl (7E)-7-[3-(dimethylcarbamothioyloxy)-5-[(E)-oct-1-enyl]-2-oxocyclopent-3-en-1-ylidene]heptanoate Traditional Name: (7E)-7-[3-(dimethylthiocarbamoyloxy)-2-keto-5-[(E)-oct-1-enyl]cyclopent-3-en-1-ylidene]enanthic acid ethyl ester Formula: C25H39NO4S MolecularWeight: 449.64646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC=CC1C=C(C(=O)C1=CCCCCCC(=O)OCC)OC(=S)N(C)C

Isomeric SMILES

CCCCCC/C=C/C\1C=C(C(=O)/C1=C/CCCCCC(=O)OCC)OC(=S)N(C)C

InChI

InChI=1S/C25H39NO4S/c1-5-7-8-9-10-13-16-20-19-22(30-25(31)26(3)4)24(28)21(20)17-14-11-12-15-18-23(27)29-6-2/h13,16-17,19-20H,5-12,14-15,18H2,1-4H3/b16-13+,21-17+