2-(4-methyl-1-octadecoxy-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 2-(4-methyl-1-octadecoxy-pent-3-enyl)-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 5,8-dihydroxy-2-(4-methyl-1-octadecoxy-pent-3-enyl)naphthalene-1,4-dione CAS Name: 5,8-dihydroxy-2-(4-methyl-1-octadecoxypent-3-enyl)naphthalene-1,4-dione IUPAC Name: 5,8-dihydroxy-2-(4-methyl-1-octadecoxypent-3-enyl)naphthalene-1,4-dione Traditional Name: 5,8-dihydroxy-2-(4-methyl-1-stearyloxy-pent-3-enyl)-1,4-naphthoquinone Formula: C34H52O5 MolecularWeight: 540.77368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(CC=C(C)C)C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O

InChI

InChI=1S/C34H52O5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-39-31(23-20-26(2)3)27-25-30(37)32-28(35)21-22-29(36)33(32)34(27)38/h20-22,25,31,35-36H,4-19,23-24H2,1-3H3