6-[[2-(diethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 6-[[2-(diethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[[2-(diethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[[2-(diethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-[[2-(diethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-[2-(diethylamino)benzyl]-1-(2-hydroxyethyl)-4-keto-quinoline-3-carboxylic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=CC=C1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

Isomeric SMILES

CCN(CC)C1=CC=CC=C1CC2=CC3=C(C=C2)N(C=C(C3=O)C(=O)O)CCO

InChI

InChI=1S/C23H26N2O4/c1-3-24(4-2)20-8-6-5-7-17(20)13-16-9-10-21-18(14-16)22(27)19(23(28)29)15-25(21)11-12-26/h5-10,14-15,26H,3-4,11-13H2,1-2H3,(H,28,29)