5,7-dimethoxy-2-(2-oxidanylidenepropyl)-3-(phenoxymethyl)naphthalene-1,4-dione

Systemtic Name: 5,7-dimethoxy-2-(2-oxidanylidenepropyl)-3-(phenoxymethyl)naphthalene-1,4-dione Openeye Name: 2-acetonyl-5,7-dimethoxy-3-(phenoxymethyl)naphthalene-1,4-dione CAS Name: 5,7-dimethoxy-2-(2-oxopropyl)-3-(phenoxymethyl)naphthalene-1,4-dione IUPAC Name: 5,7-dimethoxy-2-(2-oxopropyl)-3-(phenoxymethyl)naphthalene-1,4-dione Traditional Name: 2-acetonyl-5,7-dimethoxy-3-(phenoxymethyl)-1,4-naphthoquinone Formula: C22H20O6 MolecularWeight: 380.3906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=C(C(=O)C2=C(C=C(C=C2C1=O)OC)OC)COC3=CC=CC=C3

Isomeric SMILES

CC(=O)CC1=C(C(=O)C2=C(C=C(C=C2C1=O)OC)OC)COC3=CC=CC=C3

InChI

InChI=1S/C22H20O6/c1-13(23)9-16-18(12-28-14-7-5-4-6-8-14)22(25)20-17(21(16)24)10-15(26-2)11-19(20)27-3/h4-8,10-11H,9,12H2,1-3H3