4-[4-(diethylamino)-2-methyl-phenyl]carbonylbenzene-1,3-dicarboxylic acid

Systemtic Name: 4-[4-(diethylamino)-2-methyl-phenyl]carbonylbenzene-1,3-dicarboxylic acid Openeye Name: 4-[4-(diethylamino)-2-methyl-benzoyl]benzene-1,3-dicarboxylic acid CAS Name: 4-[[4-(diethylamino)-2-methylphenyl]-oxomethyl]benzene-1,3-dicarboxylic acid IUPAC Name: 4-[4-(diethylamino)-2-methylbenzoyl]benzene-1,3-dicarboxylic acid Traditional Name: 4-[4-(diethylamino)-2-methyl-benzoyl]isophthalic acid Formula: C20H21NO5 MolecularWeight: 355.38444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)C

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)C(=O)C2=C(C=C(C=C2)C(=O)O)C(=O)O)C

InChI

InChI=1S/C20H21NO5/c1-4-21(5-2)14-7-9-15(12(3)10-14)18(22)16-8-6-13(19(23)24)11-17(16)20(25)26/h6-11H,4-5H2,1-3H3,(H,23,24)(H,25,26)