1-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]tridecyl hexanoate

Systemtic Name: 1-[5,8-bis(oxidanyl)-1,4-bis(oxidanylidene)naphthalen-2-yl]tridecyl hexanoate Openeye Name: 1-(5,8-dihydroxy-1,4-dioxo-2-naphthyl)tridecyl hexanoate CAS Name: hexanoic acid 1-(5,8-dihydroxy-1,4-dioxo-2-naphthalenyl)tridecyl ester IUPAC Name: 1-(5,8-dihydroxy-1,4-dioxonaphthalen-2-yl)tridecyl hexanoate Traditional Name: hexanoic acid 1-(5,8-dihydroxy-1,4-diketo-2-naphthyl)tridecyl ester Formula: C29H42O6 MolecularWeight: 486.64018

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CCCCC

Isomeric SMILES

CCCCCCCCCCCCC(C1=CC(=O)C2=C(C=CC(=C2C1=O)O)O)OC(=O)CCCCC

InChI

InChI=1S/C29H42O6/c1-3-5-7-8-9-10-11-12-13-15-16-25(35-26(33)17-14-6-4-2)21-20-24(32)27-22(30)18-19-23(31)28(27)29(21)34/h18-20,25,30-31H,3-17H2,1-2H3