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

Systemtic Name: 3-[(4-tert-butylcyclohexyl)methyl]-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-[(4-tert-butylcyclohexyl)methyl]-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-[(4-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-[(4-tert-butylcyclohexyl)methyl]-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-[(4-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)C1CCC(CC1)CC2=C(C3=CC=CC=C3C(=O)C2=O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)CC2=C(C3=CC=CC=C3C(=O)C2=O)O

InChI

InChI=1S/C21H26O3/c1-21(2,3)14-10-8-13(9-11-14)12-17-18(22)15-6-4-5-7-16(15)19(23)20(17)24/h4-7,13-14,22H,8-12H2,1-3H3