8-[[bis(2-methoxyethyl)azaniumyl]methyl]-3-(4-chlorophenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-olate

Systemtic Name: 8-[[bis(2-methoxyethyl)azaniumyl]methyl]-3-(4-chlorophenyl)-7-oxidanyl-4-oxidanylidene-chromen-2-olate Openeye Name: 8-[[bis(2-methoxyethyl)ammonio]methyl]-3-(4-chlorophenyl)-7-hydroxy-4-oxo-chromen-2-olate CAS Name: 8-[[bis(2-methoxyethyl)ammonio]methyl]-3-(4-chlorophenyl)-7-hydroxy-4-oxo-1-benzopyran-2-olate IUPAC Name: 8-[[bis(2-methoxyethyl)azaniumyl]methyl]-3-(4-chlorophenyl)-7-hydroxy-4-oxochromen-2-olate Traditional Name: 8-[[bis(2-methoxyethyl)ammonio]methyl]-3-(4-chlorophenyl)-7-hydroxy-4-keto-chromen-2-olate Formula: C22H24ClNO6 MolecularWeight: 433.88206

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CCOC)CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=C(C=C3)Cl)[O-])O

Isomeric SMILES

COCC[NH+](CCOC)CC1=C(C=CC2=C1OC(=C(C2=O)C3=CC=C(C=C3)Cl)[O-])O

InChI

InChI=1S/C22H24ClNO6/c1-28-11-9-24(10-12-29-2)13-17-18(25)8-7-16-20(26)19(22(27)30-21(16)17)14-3-5-15(23)6-4-14/h3-8,25,27H,9-13H2,1-2H3