2-[3,5-bis(oxidanylidene)hexyl]-3-bromanyl-naphthalene-1,4-dione

Systemtic Name: 2-[3,5-bis(oxidanylidene)hexyl]-3-bromanyl-naphthalene-1,4-dione Openeye Name: 2-bromo-3-(3,5-dioxohexyl)naphthalene-1,4-dione CAS Name: 2-bromo-3-(3,5-dioxohexyl)naphthalene-1,4-dione IUPAC Name: 2-bromo-3-(3,5-dioxohexyl)naphthalene-1,4-dione Traditional Name: 2-bromo-3-(3,5-diketohexyl)-1,4-naphthoquinone Formula: C16H13BrO4 MolecularWeight: 349.17602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)CCC1=C(C(=O)C2=CC=CC=C2C1=O)Br

Isomeric SMILES

CC(=O)CC(=O)CCC1=C(C(=O)C2=CC=CC=C2C1=O)Br

InChI

InChI=1S/C16H13BrO4/c1-9(18)8-10(19)6-7-13-14(17)16(21)12-5-3-2-4-11(12)15(13)20/h2-5H,6-8H2,1H3