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

Systemtic Name: 3-[(1-tert-butylcyclohexyl)methyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[(1-tert-butylcyclohexyl)methyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[(1-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[(1-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[(1-tert-butylcyclohexyl)methyl]-4-hydroxy-1,2-naphthoquinone Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)CC2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CC(C)(C)C1(CCCCC1)CC2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C21H26O3/c1-20(2,3)21(11-7-4-8-12-21)13-16-17(22)14-9-5-6-10-15(14)18(23)19(16)24/h5-6,9-10,22H,4,7-8,11-13H2,1-3H3