ethyl 2-[3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl]oxyethanoate

Systemtic Name: ethyl 2-[3-(4-chlorophenyl)-6-hexyl-4-oxidanylidene-chromen-7-yl]oxyethanoate Openeye Name: ethyl 2-[3-(4-chlorophenyl)-6-hexyl-4-oxo-chromen-7-yl]oxyacetate CAS Name: 2-[[3-(4-chlorophenyl)-6-hexyl-4-oxo-1-benzopyran-7-yl]oxy]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(4-chlorophenyl)-6-hexyl-4-oxochromen-7-yl]oxyacetate Traditional Name: 2-[3-(4-chlorophenyl)-6-hexyl-4-keto-chromen-7-yl]oxyacetic acid ethyl ester Formula: C25H27ClO5 MolecularWeight: 442.93188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OCC(=O)OCC

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=CC=C(C=C3)Cl)OCC(=O)OCC

InChI

InChI=1S/C25H27ClO5/c1-3-5-6-7-8-18-13-20-23(14-22(18)31-16-24(27)29-4-2)30-15-21(25(20)28)17-9-11-19(26)12-10-17/h9-15H,3-8,16H2,1-2H3