2-(2-cyclohexyl-4-pentan-2-yl-phenyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 2-(2-cyclohexyl-4-pentan-2-yl-phenyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 2-[2-cyclohexyl-4-(1-methylbutyl)phenyl]-5,8-dihydroxy-naphthalene-1,4-dione CAS Name: 2-(2-cyclohexyl-4-pentan-2-ylphenyl)-5,8-dihydroxynaphthalene-1,4-dione IUPAC Name: 2-(2-cyclohexyl-4-pentan-2-ylphenyl)-5,8-dihydroxynaphthalene-1,4-dione Traditional Name: 2-[2-cyclohexyl-4-(1-methylbutyl)phenyl]-5,8-dihydroxy-1,4-naphthoquinone Formula: C27H30O4 MolecularWeight: 418.5247

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC(=C(C=C1)C2=CC(=O)C3=C(C=CC(=C3C2=O)O)O)C4CCCCC4

Isomeric SMILES

CCCC(C)C1=CC(=C(C=C1)C2=CC(=O)C3=C(C=CC(=C3C2=O)O)O)C4CCCCC4

InChI

InChI=1S/C27H30O4/c1-3-7-16(2)18-10-11-19(20(14-18)17-8-5-4-6-9-17)21-15-24(30)25-22(28)12-13-23(29)26(25)27(21)31/h10-17,28-29H,3-9H2,1-2H3