2-bromanyl-6-butyl-7,8-dimethoxy-naphthalene-1,4-dione

Systemtic Name: 2-bromanyl-6-butyl-7,8-dimethoxy-naphthalene-1,4-dione Openeye Name: 2-bromo-6-butyl-7,8-dimethoxy-naphthalene-1,4-dione CAS Name: 2-bromo-6-butyl-7,8-dimethoxynaphthalene-1,4-dione IUPAC Name: 2-bromo-6-butyl-7,8-dimethoxynaphthalene-1,4-dione Traditional Name: 2-bromo-6-butyl-7,8-dimethoxy-1,4-naphthoquinone Formula: C16H17BrO4 MolecularWeight: 353.20778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=C2C(=C1)C(=O)C=C(C2=O)Br)OC)OC

Isomeric SMILES

CCCCC1=C(C(=C2C(=C1)C(=O)C=C(C2=O)Br)OC)OC

InChI

InChI=1S/C16H17BrO4/c1-4-5-6-9-7-10-12(18)8-11(17)14(19)13(10)16(21-3)15(9)20-2/h7-8H,4-6H2,1-3H3