icosyl 4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]benzoate

Systemtic Name: icosyl 4-[7-(diethylamino)-2-oxidanylidene-chromen-3-yl]benzoate Openeye Name: icosyl 4-[7-(diethylamino)-2-oxo-chromen-3-yl]benzoate CAS Name: 4-[7-(diethylamino)-2-oxo-1-benzopyran-3-yl]benzoic acid eicosyl ester IUPAC Name: icosyl 4-[7-(diethylamino)-2-oxochromen-3-yl]benzoate Traditional Name: 4-[7-(diethylamino)-2-keto-chromen-3-yl]benzoic acid arachyl ester Formula: C40H59NO4 MolecularWeight: 617.90076

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC3=C(C=C(C=C3)N(CC)CC)OC2=O

InChI

InChI=1S/C40H59NO4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-30-44-39(42)34-26-24-33(25-27-34)37-31-35-28-29-36(41(5-2)6-3)32-38(35)45-40(37)43/h24-29,31-32H,4-23,30H2,1-3H3