1-[1,4-dimethoxy-5,8-bis(oxidanylidene)naphthalen-2-yl]pentyl butanoate

Systemtic Name: 1-[1,4-dimethoxy-5,8-bis(oxidanylidene)naphthalen-2-yl]pentyl butanoate Openeye Name: 1-(1,4-dimethoxy-5,8-dioxo-2-naphthyl)pentyl butanoate CAS Name: butanoic acid 1-(1,4-dimethoxy-5,8-dioxo-2-naphthalenyl)pentyl ester IUPAC Name: 1-(1,4-dimethoxy-5,8-dioxonaphthalen-2-yl)pentyl butanoate Traditional Name: butyric acid 1-(5,8-diketo-1,4-dimethoxy-2-naphthyl)pentyl ester Formula: C21H26O6 MolecularWeight: 374.42754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)OC(=O)CCC

Isomeric SMILES

CCCCC(C1=CC(=C2C(=O)C=CC(=O)C2=C1OC)OC)OC(=O)CCC

InChI

InChI=1S/C21H26O6/c1-5-7-9-16(27-18(24)8-6-2)13-12-17(25-3)19-14(22)10-11-15(23)20(19)21(13)26-4/h10-12,16H,5-9H2,1-4H3