3-[(Z)-2-iodanyl-3-methyl-but-1-enyl]-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-[(Z)-2-iodanyl-3-methyl-but-1-enyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-[(Z)-2-iodo-3-methyl-but-1-enyl]naphthalene-1,2-dione CAS Name: 4-hydroxy-3-[(Z)-2-iodo-3-methylbut-1-enyl]naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-[(Z)-2-iodo-3-methylbut-1-enyl]naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-[(Z)-2-iodo-3-methyl-but-1-enyl]-1,2-naphthoquinone Formula: C15H13IO3 MolecularWeight: 368.16639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=CC1=C(C2=CC=CC=C2C(=O)C1=O)O)I

Isomeric SMILES

CC(C)/C(=C/C1=C(C2=CC=CC=C2C(=O)C1=O)O)/I

InChI

InChI=1S/C15H13IO3/c1-8(2)12(16)7-11-13(17)9-5-3-4-6-10(9)14(18)15(11)19/h3-8,17H,1-2H3/b12-7-