5-(2-ethylsulfanylpentyl)-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-dione

Systemtic Name: 5-(2-ethylsulfanylpentyl)-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-dione Openeye Name: 5-(2-ethylsulfanylpentyl)-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-dione CAS Name: 5-[2-(ethylthio)pentyl]-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-dione IUPAC Name: 5-(2-ethylsulfanylpentyl)-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-dione Traditional Name: 5-[2-(ethylthio)pentyl]-2-[1-(propoxyamino)hexylidene]cyclohexane-1,3-quinone Formula: C22H39NO3S MolecularWeight: 397.61496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=C1C(=O)CC(CC1=O)CC(CCC)SCC)NOCCC

Isomeric SMILES

CCCCCC(=C1C(=O)CC(CC1=O)CC(CCC)SCC)NOCCC

InChI

InChI=1S/C22H39NO3S/c1-5-9-10-12-19(23-26-13-7-3)22-20(24)15-17(16-21(22)25)14-18(11-6-2)27-8-4/h17-18,23H,5-16H2,1-4H3