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

Systemtic Name: 3-(bromomethyl)-5,7-dimethoxy-2-(2-oxidanylidenepropyl)naphthalene-1,4-dione Openeye Name: 2-acetonyl-3-(bromomethyl)-5,7-dimethoxy-naphthalene-1,4-dione CAS Name: 3-(bromomethyl)-5,7-dimethoxy-2-(2-oxopropyl)naphthalene-1,4-dione IUPAC Name: 3-(bromomethyl)-5,7-dimethoxy-2-(2-oxopropyl)naphthalene-1,4-dione Traditional Name: 2-acetonyl-3-(bromomethyl)-5,7-dimethoxy-1,4-naphthoquinone Formula: C16H15BrO5 MolecularWeight: 367.1913

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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)CBr

Isomeric SMILES

CC(=O)CC1=C(C(=O)C2=C(C=C(C=C2C1=O)OC)OC)CBr

InChI

InChI=1S/C16H15BrO5/c1-8(18)4-10-12(7-17)16(20)14-11(15(10)19)5-9(21-2)6-13(14)22-3/h5-6H,4,7H2,1-3H3