3-chloranyl-2-hexyl-6-methyl-naphthalene-1,4-dione

Systemtic Name: 3-chloranyl-2-hexyl-6-methyl-naphthalene-1,4-dione Openeye Name: 3-chloro-2-hexyl-6-methyl-naphthalene-1,4-dione CAS Name: 3-chloro-2-hexyl-6-methylnaphthalene-1,4-dione IUPAC Name: 3-chloro-2-hexyl-6-methylnaphthalene-1,4-dione Traditional Name: 3-chloro-2-hexyl-6-methyl-1,4-naphthoquinone Formula: C17H19ClO2 MolecularWeight: 290.78456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=O)C2=C(C1=O)C=CC(=C2)C)Cl

Isomeric SMILES

CCCCCCC1=C(C(=O)C2=C(C1=O)C=CC(=C2)C)Cl

InChI

InChI=1S/C17H19ClO2/c1-3-4-5-6-7-13-15(18)17(20)14-10-11(2)8-9-12(14)16(13)19/h8-10H,3-7H2,1-2H3