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

Systemtic Name: 2-(chloromethyl)-3-pentyl-naphthalene-1,4-dione Openeye Name: 2-(chloromethyl)-3-pentyl-naphthalene-1,4-dione CAS Name: 2-(chloromethyl)-3-pentylnaphthalene-1,4-dione IUPAC Name: 2-(chloromethyl)-3-pentylnaphthalene-1,4-dione Traditional Name: 2-amyl-3-(chloromethyl)-1,4-naphthoquinone Formula: C16H17ClO2 MolecularWeight: 276.75798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CCl

Isomeric SMILES

CCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)CCl

InChI

InChI=1S/C16H17ClO2/c1-2-3-4-7-13-14(10-17)16(19)12-9-6-5-8-11(12)15(13)18/h5-6,8-9H,2-4,7,10H2,1H3