methyl 4-[8-(diethylaminomethyl)-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate

Systemtic Name: methyl 4-[8-(diethylaminomethyl)-7-oxidanyl-4-oxidanylidene-chromen-3-yl]oxybenzoate Openeye Name: methyl 4-[8-(diethylaminomethyl)-7-hydroxy-4-oxo-chromen-3-yl]oxybenzoate CAS Name: 4-[[8-(diethylaminomethyl)-7-hydroxy-4-oxo-1-benzopyran-3-yl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[8-(diethylaminomethyl)-7-hydroxy-4-oxochromen-3-yl]oxybenzoate Traditional Name: 4-[8-(diethylaminomethyl)-7-hydroxy-4-keto-chromen-3-yl]oxybenzoic acid methyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=C(C=C3)C(=O)OC)O

Isomeric SMILES

CCN(CC)CC1=C(C=CC2=C1OC=C(C2=O)OC3=CC=C(C=C3)C(=O)OC)O

InChI

InChI=1S/C22H23NO6/c1-4-23(5-2)12-17-18(24)11-10-16-20(25)19(13-28-21(16)17)29-15-8-6-14(7-9-15)22(26)27-3/h6-11,13,24H,4-5,12H2,1-3H3