3-(2-methylpropyl)-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-(2-methylpropyl)-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 4-hydroxy-3-isobutyl-naphthalene-1,2-dione CAS Name: 4-hydroxy-3-(2-methylpropyl)naphthalene-1,2-dione IUPAC Name: 4-hydroxy-3-(2-methylpropyl)naphthalene-1,2-dione Traditional Name: 4-hydroxy-3-isobutyl-1,2-naphthoquinone Formula: C14H14O3 MolecularWeight: 230.25916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14O3/c1-8(2)7-11-12(15)9-5-3-4-6-10(9)13(16)14(11)17/h3-6,8,15H,7H2,1-2H3