[(2R)-1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3,4,5-triethoxybenzoate

Systemtic Name: [(2R)-1-(2,3-dihydro-1H-inden-5-yl)-1-oxidanylidene-propan-2-yl] 3,4,5-triethoxybenzoate Openeye Name: [(1R)-2-indan-5-yl-1-methyl-2-oxo-ethyl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [(2R)-1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2,3-dihydro-1H-inden-5-yl)-1-oxopropan-2-yl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [(1R)-2-indan-5-yl-2-keto-1-methyl-ethyl] ester Formula: C25H30O6 MolecularWeight: 426.5021

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC(C)C(=O)C2=CC3=C(CCC3)C=C2

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)O[C@H](C)C(=O)C2=CC3=C(CCC3)C=C2

InChI

InChI=1S/C25H30O6/c1-5-28-21-14-20(15-22(29-6-2)24(21)30-7-3)25(27)31-16(4)23(26)19-12-11-17-9-8-10-18(17)13-19/h11-16H,5-10H2,1-4H3/t16-/m1/s1