2-(chloromethyl)-3-heptyl-naphthalene-1,4-dione

Systemtic Name: 2-(chloromethyl)-3-heptyl-naphthalene-1,4-dione Openeye Name: 2-(chloromethyl)-3-heptyl-naphthalene-1,4-dione CAS Name: 2-(chloromethyl)-3-heptylnaphthalene-1,4-dione IUPAC Name: 2-(chloromethyl)-3-heptylnaphthalene-1,4-dione Traditional Name: 2-(chloromethyl)-3-heptyl-1,4-naphthoquinone Formula: C18H21ClO2 MolecularWeight: 304.81114

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CCl

Isomeric SMILES

CCCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CCl

InChI

InChI=1S/C18H21ClO2/c1-2-3-4-5-6-9-15-16(12-19)18(21)14-11-8-7-10-13(14)17(15)20/h7-8,10-11H,2-6,9,12H2,1H3