2-[(3,4-diethoxyphenyl)-oxidanyl-methyl]naphthalene-1,4-dione

Systemtic Name: 2-[(3,4-diethoxyphenyl)-oxidanyl-methyl]naphthalene-1,4-dione Openeye Name: 2-[(3,4-diethoxyphenyl)-hydroxy-methyl]naphthalene-1,4-dione CAS Name: 2-[(3,4-diethoxyphenyl)-hydroxymethyl]naphthalene-1,4-dione IUPAC Name: 2-[(3,4-diethoxyphenyl)-hydroxymethyl]naphthalene-1,4-dione Traditional Name: 2-[(3,4-diethoxyphenyl)-hydroxy-methyl]-1,4-naphthoquinone Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C2=CC(=O)C3=CC=CC=C3C2=O)O)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C2=CC(=O)C3=CC=CC=C3C2=O)O)OCC

InChI

InChI=1S/C21H20O5/c1-3-25-18-10-9-13(11-19(18)26-4-2)20(23)16-12-17(22)14-7-5-6-8-15(14)21(16)24/h5-12,20,23H,3-4H2,1-2H3