3-(5-ethyl-2-methyl-nonyl)-4-oxidanyl-naphthalene-1,2-dione

Systemtic Name: 3-(5-ethyl-2-methyl-nonyl)-4-oxidanyl-naphthalene-1,2-dione Openeye Name: 3-(5-ethyl-2-methyl-nonyl)-4-hydroxy-naphthalene-1,2-dione CAS Name: 3-(5-ethyl-2-methylnonyl)-4-hydroxynaphthalene-1,2-dione IUPAC Name: 3-(5-ethyl-2-methylnonyl)-4-hydroxynaphthalene-1,2-dione Traditional Name: 3-(5-ethyl-2-methyl-nonyl)-4-hydroxy-1,2-naphthoquinone Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CCC(C)CC1=C(C2=CC=CC=C2C(=O)C1=O)O

Isomeric SMILES

CCCCC(CC)CCC(C)CC1=C(C2=CC=CC=C2C(=O)C1=O)O

InChI

InChI=1S/C22H30O3/c1-4-6-9-16(5-2)13-12-15(3)14-19-20(23)17-10-7-8-11-18(17)21(24)22(19)25/h7-8,10-11,15-16,23H,4-6,9,12-14H2,1-3H3