2-hexyl-3-methoxy-naphthalene-1,4-dione

Systemtic Name: 2-hexyl-3-methoxy-naphthalene-1,4-dione Openeye Name: 2-hexyl-3-methoxy-naphthalene-1,4-dione CAS Name: 2-hexyl-3-methoxynaphthalene-1,4-dione IUPAC Name: 2-hexyl-3-methoxynaphthalene-1,4-dione Traditional Name: 2-hexyl-3-methoxy-1,4-naphthoquinone Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)OC

Isomeric SMILES

CCCCCCC1=C(C(=O)C2=CC=CC=C2C1=O)OC

InChI

InChI=1S/C17H20O3/c1-3-4-5-6-11-14-15(18)12-9-7-8-10-13(12)16(19)17(14)20-2/h7-10H,3-6,11H2,1-2H3