3-(1-tert-butylcyclohexyl)-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-(1-tert-butylcyclohexyl)-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-(1-tert-butylcyclohexyl)-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-(1-tert-butylcyclohexyl)-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-(1-tert-butylcyclohexyl)-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-(1-tert-butylcyclohexyl)-4-hydroxy-1,2-naphthoquinone Formula: C20H24O3 MolecularWeight: 312.40276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)C2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CC(C)(C)C1(CCCCC1)C2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C20H24O3/c1-19(2,3)20(11-7-4-8-12-20)15-16(21)13-9-5-6-10-14(13)17(22)18(15)23/h5-6,9-10,21H,4,7-8,11-12H2,1-3H3