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

Systemtic Name: 6-[[2-(dimethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 6-[[2-(dimethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 6-[[2-(dimethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 6-[[2-(dimethylamino)phenyl]methyl]-1-(2-hydroxyethyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 6-[2-(dimethylamino)benzyl]-1-(2-hydroxyethyl)-4-keto-quinoline-3-carboxylic acid Formula: C21H22N2O4 MolecularWeight: 366.41038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O4/c1-22(2)18-6-4-3-5-15(18)11-14-7-8-19-16(12-14)20(25)17(21(26)27)13-23(19)9-10-24/h3-8,12-13,24H,9-11H2,1-2H3,(H,26,27)