3-butyl-5-methoxy-2-methyl-naphthalene-1,4-dione

Systemtic Name: 3-butyl-5-methoxy-2-methyl-naphthalene-1,4-dione Openeye Name: 3-butyl-5-methoxy-2-methyl-naphthalene-1,4-dione CAS Name: 3-butyl-5-methoxy-2-methylnaphthalene-1,4-dione IUPAC Name: 3-butyl-5-methoxy-2-methylnaphthalene-1,4-dione Traditional Name: 3-butyl-5-methoxy-2-methyl-1,4-naphthoquinone Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=O)C2=C(C1=O)C(=CC=C2)OC)C

Isomeric SMILES

CCCCC1=C(C(=O)C2=C(C1=O)C(=CC=C2)OC)C

InChI

InChI=1S/C16H18O3/c1-4-5-7-11-10(2)15(17)12-8-6-9-13(19-3)14(12)16(11)18/h6,8-9H,4-5,7H2,1-3H3