5-chloranyl-2-dodecyl-3-oxidanyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 5-chloranyl-2-dodecyl-3-oxidanyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 5-chloro-2-dodecyl-3-hydroxy-1,4-benzoquinone CAS Name: 5-chloro-2-dodecyl-3-hydroxycyclohexa-2,5-diene-1,4-dione IUPAC Name: 5-chloro-2-dodecyl-3-hydroxycyclohexa-2,5-diene-1,4-dione Traditional Name: 5-chloro-3-hydroxy-2-lauryl-p-benzoquinone Formula: C18H27ClO3 MolecularWeight: 326.85818

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C(=O)C(=CC1=O)Cl)O

Isomeric SMILES

CCCCCCCCCCCCC1=C(C(=O)C(=CC1=O)Cl)O

InChI

InChI=1S/C18H27ClO3/c1-2-3-4-5-6-7-8-9-10-11-12-14-16(20)13-15(19)18(22)17(14)21/h13,21H,2-12H2,1H3