2-methyl-5,8-bis(oxidanyl)-6-[(2-phenethylcyclopentyl)methyl]naphthalene-1,4-dione

Systemtic Name: 2-methyl-5,8-bis(oxidanyl)-6-[(2-phenethylcyclopentyl)methyl]naphthalene-1,4-dione Openeye Name: 5,8-dihydroxy-2-methyl-6-[(2-phenethylcyclopentyl)methyl]naphthalene-1,4-dione CAS Name: 5,8-dihydroxy-2-methyl-6-[(2-phenethylcyclopentyl)methyl]naphthalene-1,4-dione IUPAC Name: 5,8-dihydroxy-2-methyl-6-[(2-phenethylcyclopentyl)methyl]naphthalene-1,4-dione Traditional Name: 5,8-dihydroxy-2-methyl-6-[(2-phenethylcyclopentyl)methyl]-1,4-naphthoquinone Formula: C25H26O4 MolecularWeight: 390.47154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=C(C(=CC(=C2C1=O)O)CC3CCCC3CCC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC(=O)C2=C(C(=CC(=C2C1=O)O)CC3CCCC3CCC4=CC=CC=C4)O

InChI

InChI=1S/C25H26O4/c1-15-12-20(26)23-22(24(15)28)21(27)14-19(25(23)29)13-18-9-5-8-17(18)11-10-16-6-3-2-4-7-16/h2-4,6-7,12,14,17-18,27,29H,5,8-11,13H2,1H3