3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl 1,4-dimethoxynaphthalene-2-carboxylate

Systemtic Name: 3-[1-oxidanyl-3,4-bis(oxidanylidene)naphthalen-2-yl]propyl 1,4-dimethoxynaphthalene-2-carboxylate Openeye Name: 3-(1-hydroxy-3,4-dioxo-2-naphthyl)propyl 1,4-dimethoxynaphthalene-2-carboxylate CAS Name: 1,4-dimethoxy-2-naphthalenecarboxylic acid 3-(1-hydroxy-3,4-dioxo-2-naphthalenyl)propyl ester IUPAC Name: 3-(1-hydroxy-3,4-dioxonaphthalen-2-yl)propyl 1,4-dimethoxynaphthalene-2-carboxylate Traditional Name: 1,4-dimethoxynaphthalene-2-carboxylic acid 3-(1-hydroxy-3,4-diketo-2-naphthyl)propyl ester Formula: C26H22O7 MolecularWeight: 446.44868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C2=CC=CC=C21)OC)C(=O)OCCCC3=C(C4=CC=CC=C4C(=O)C3=O)O

Isomeric SMILES

COC1=CC(=C(C2=CC=CC=C21)OC)C(=O)OCCCC3=C(C4=CC=CC=C4C(=O)C3=O)O

InChI

InChI=1S/C26H22O7/c1-31-21-14-20(25(32-2)18-11-6-3-8-15(18)21)26(30)33-13-7-12-19-22(27)16-9-4-5-10-17(16)23(28)24(19)29/h3-6,8-11,14,27H,7,12-13H2,1-2H3