(5E)-5-(3-butylsulfanylpropylidene)-2-chloranyl-3-(dimethylamino)-4,4-dimethoxy-cyclopent-2-en-1-one

Systemtic Name: (5E)-5-(3-butylsulfanylpropylidene)-2-chloranyl-3-(dimethylamino)-4,4-dimethoxy-cyclopent-2-en-1-one Openeye Name: (5E)-5-(3-butylsulfanylpropylidene)-2-chloro-3-(dimethylamino)-4,4-dimethoxy-cyclopent-2-en-1-one CAS Name: (5E)-5-[3-(butylthio)propylidene]-2-chloro-3-(dimethylamino)-4,4-dimethoxy-1-cyclopent-2-enone IUPAC Name: (5E)-5-(3-butylsulfanylpropylidene)-2-chloro-3-(dimethylamino)-4,4-dimethoxycyclopent-2-en-1-one Traditional Name: (5E)-5-[3-(butylthio)propylidene]-2-chloro-3-(dimethylamino)-4,4-dimethoxy-cyclopent-2-en-1-one Formula: C16H26ClNO3S MolecularWeight: 347.90054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCCC=C1C(=O)C(=C(C1(OC)OC)N(C)C)Cl

Isomeric SMILES

CCCCSCC/C=C/1\C(=O)C(=C(C1(OC)OC)N(C)C)Cl

InChI

InChI=1S/C16H26ClNO3S/c1-6-7-10-22-11-8-9-12-14(19)13(17)15(18(2)3)16(12,20-4)21-5/h9H,6-8,10-11H2,1-5H3/b12-9+