methyl 4-[4-(4,5,6,7-tetramethoxy-3-oxidanylidene-1,2-dihydroinden-2-yl)butoxy]benzoate

Systemtic Name: methyl 4-[4-(4,5,6,7-tetramethoxy-3-oxidanylidene-1,2-dihydroinden-2-yl)butoxy]benzoate Openeye Name: methyl 4-[4-(4,5,6,7-tetramethoxy-1-oxo-indan-2-yl)butoxy]benzoate CAS Name: 4-[4-(4,5,6,7-tetramethoxy-3-oxo-1,2-dihydroinden-2-yl)butoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(4,5,6,7-tetramethoxy-3-oxo-1,2-dihydroinden-2-yl)butoxy]benzoate Traditional Name: 4-[4-(1-keto-4,5,6,7-tetramethoxy-indan-2-yl)butoxy]benzoic acid methyl ester Formula: C25H30O8 MolecularWeight: 458.5009

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C2=C1CC(C2=O)CCCCOC3=CC=C(C=C3)C(=O)OC)OC)OC)OC

Isomeric SMILES

COC1=C(C(=C(C2=C1CC(C2=O)CCCCOC3=CC=C(C=C3)C(=O)OC)OC)OC)OC

InChI

InChI=1S/C25H30O8/c1-28-21-18-14-16(20(26)19(18)22(29-2)24(31-4)23(21)30-3)8-6-7-13-33-17-11-9-15(10-12-17)25(27)32-5/h9-12,16H,6-8,13-14H2,1-5H3