(2E)-4-dodecylsulfanyl-2-[oxidanyl(phenyl)methylidene]cyclopentane-1,3-dione

Systemtic Name: (2E)-4-dodecylsulfanyl-2-[oxidanyl(phenyl)methylidene]cyclopentane-1,3-dione Openeye Name: (2E)-4-dodecylsulfanyl-2-[hydroxy(phenyl)methylene]cyclopentane-1,3-dione CAS Name: (2E)-4-(dodecylthio)-2-[hydroxy(phenyl)methylidene]cyclopentane-1,3-dione IUPAC Name: (2E)-4-dodecylsulfanyl-2-[hydroxy(phenyl)methylidene]cyclopentane-1,3-dione Traditional Name: (2E)-2-[hydroxy(phenyl)methylene]-4-(laurylthio)cyclopentane-1,3-quinone Formula: C24H34O3S MolecularWeight: 402.58996

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1CC(=O)C(=C(C2=CC=CC=C2)O)C1=O

Isomeric SMILES

CCCCCCCCCCCCSC1CC(=O)/C(=C(/C2=CC=CC=C2)\O)/C1=O

InChI

InChI=1S/C24H34O3S/c1-2-3-4-5-6-7-8-9-10-14-17-28-21-18-20(25)22(24(21)27)23(26)19-15-12-11-13-16-19/h11-13,15-16,21,26H,2-10,14,17-18H2,1H3/b23-22+