methyl 2-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylamino]-4,5-dimethoxy-benzoate

Systemtic Name: methyl 2-[(6-ethyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methylamino]-4,5-dimethoxy-benzoate Openeye Name: methyl 2-[(6-ethyl-7-hydroxy-2-oxo-chromen-4-yl)methylamino]-4,5-dimethoxy-benzoate CAS Name: 2-[(6-ethyl-7-hydroxy-2-oxo-1-benzopyran-4-yl)methylamino]-4,5-dimethoxybenzoic acid methyl ester IUPAC Name: methyl 2-[(6-ethyl-7-hydroxy-2-oxochromen-4-yl)methylamino]-4,5-dimethoxybenzoate Traditional Name: 2-[(6-ethyl-7-hydroxy-2-keto-chromen-4-yl)methylamino]-4,5-dimethoxy-benzoic acid methyl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=CC(=C(C=C3C(=O)OC)OC)OC)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=CC(=C(C=C3C(=O)OC)OC)OC)O

InChI

InChI=1S/C22H23NO7/c1-5-12-6-14-13(7-21(25)30-18(14)10-17(12)24)11-23-16-9-20(28-3)19(27-2)8-15(16)22(26)29-4/h6-10,23-24H,5,11H2,1-4H3