7-(diethylamino)-6-[2-(4-methoxycarbonylphenyl)ethynyl]-2-oxidanylidene-chromene-3-carboxylic acid

Systemtic Name: 7-(diethylamino)-6-[2-(4-methoxycarbonylphenyl)ethynyl]-2-oxidanylidene-chromene-3-carboxylic acid Openeye Name: 7-(diethylamino)-6-[2-(4-methoxycarbonylphenyl)ethynyl]-2-oxo-chromene-3-carboxylic acid CAS Name: 7-(diethylamino)-6-[2-(4-methoxycarbonylphenyl)ethynyl]-2-oxo-1-benzopyran-3-carboxylic acid IUPAC Name: 7-(diethylamino)-6-[2-(4-methoxycarbonylphenyl)ethynyl]-2-oxochromene-3-carboxylic acid Traditional Name: 6-[2-(4-carbomethoxyphenyl)ethynyl]-7-(diethylamino)-2-keto-chromene-3-carboxylic acid Formula: C24H21NO6 MolecularWeight: 419.42664

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1C#CC3=CC=C(C=C3)C(=O)OC)C=C(C(=O)O2)C(=O)O

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1C#CC3=CC=C(C=C3)C(=O)OC)C=C(C(=O)O2)C(=O)O

InChI

InChI=1S/C24H21NO6/c1-4-25(5-2)20-14-21-18(13-19(22(26)27)24(29)31-21)12-17(20)11-8-15-6-9-16(10-7-15)23(28)30-3/h6-7,9-10,12-14H,4-5H2,1-3H3,(H,26,27)