8-chloranyl-3-dodecyl-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 8-chloranyl-3-dodecyl-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 8-chloro-3-dodecyl-4-hydroxy-naphthalene-1,2-dione CAS Name: 8-chloro-3-dodecyl-4-hydroxynaphthalene-1,2-dione IUPAC Name: 8-chloro-3-dodecyl-4-hydroxynaphthalene-1,2-dione Traditional Name: 8-chloro-4-hydroxy-3-lauryl-1,2-naphthoquinone Formula: C22H29ClO3 MolecularWeight: 376.91686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C2=C(C(=CC=C2)Cl)C(=O)C1=O)O

Isomeric SMILES

CCCCCCCCCCCCC1=C(C2=C(C(=CC=C2)Cl)C(=O)C1=O)O

InChI

InChI=1S/C22H29ClO3/c1-2-3-4-5-6-7-8-9-10-11-13-17-20(24)16-14-12-15-18(23)19(16)22(26)21(17)25/h12,14-15,24H,2-11,13H2,1H3