ethyl 4-[(6-hexyl-3-oxidanylidene-1,2-dihydroinden-5-yl)oxy]butanoate

Systemtic Name: ethyl 4-[(6-hexyl-3-oxidanylidene-1,2-dihydroinden-5-yl)oxy]butanoate Openeye Name: ethyl 4-(6-hexyl-3-oxo-indan-5-yl)oxybutanoate CAS Name: 4-[(6-hexyl-3-oxo-1,2-dihydroinden-5-yl)oxy]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(6-hexyl-3-oxo-1,2-dihydroinden-5-yl)oxy]butanoate Traditional Name: 4-(6-hexyl-3-keto-indan-5-yl)oxybutyric acid ethyl ester Formula: C21H30O4 MolecularWeight: 346.4605

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)CCC2=O)OCCCC(=O)OCC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)CCC2=O)OCCCC(=O)OCC

InChI

InChI=1S/C21H30O4/c1-3-5-6-7-9-17-14-16-11-12-19(22)18(16)15-20(17)25-13-8-10-21(23)24-4-2/h14-15H,3-13H2,1-2H3