6-ethyl-2-methoxy-8-oxidanyl-7-(2-oxidanylpropyl)naphthalene-1,4-dione

Systemtic Name: 6-ethyl-2-methoxy-8-oxidanyl-7-(2-oxidanylpropyl)naphthalene-1,4-dione Openeye Name: 6-ethyl-8-hydroxy-7-(2-hydroxypropyl)-2-methoxy-naphthalene-1,4-dione CAS Name: 6-ethyl-8-hydroxy-7-(2-hydroxypropyl)-2-methoxynaphthalene-1,4-dione IUPAC Name: 6-ethyl-8-hydroxy-7-(2-hydroxypropyl)-2-methoxynaphthalene-1,4-dione Traditional Name: 6-ethyl-8-hydroxy-7-(2-hydroxypropyl)-2-methoxy-1,4-naphthoquinone Formula: C16H18O5 MolecularWeight: 290.31112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C(=C1)C(=O)C=C(C2=O)OC)O)CC(C)O

Isomeric SMILES

CCC1=C(C(=C2C(=C1)C(=O)C=C(C2=O)OC)O)CC(C)O

InChI

InChI=1S/C16H18O5/c1-4-9-6-11-12(18)7-13(21-3)16(20)14(11)15(19)10(9)5-8(2)17/h6-8,17,19H,4-5H2,1-3H3