4-(4-methylpentyl)-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione

Systemtic Name: 4-(4-methylpentyl)-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione Openeye Name: 4-isohexyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione CAS Name: 4-(4-methylpentyl)-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione IUPAC Name: 4-(4-methylpentyl)-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione Traditional Name: 4-isohexyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-quinone Formula: C16H18O3 MolecularWeight: 258.31232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC1=CC2=C(C=C1)C(=O)C3C(C2=O)O3

Isomeric SMILES

CC(C)CCCC1=CC2=C(C=C1)C(=O)C3C(C2=O)O3

InChI

InChI=1S/C16H18O3/c1-9(2)4-3-5-10-6-7-11-12(8-10)14(18)16-15(19-16)13(11)17/h6-9,15-16H,3-5H2,1-2H3