2-(4-acetamidophenyl)-7,8-dimethyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine

Systemtic Name: 2-(4-acetamidophenyl)-7,8-dimethyl-3-oxidanyl-quinoline-4-carboxylic acid; N,N-diethylethanamine Openeye Name: 2-(4-acetamidophenyl)-3-hydroxy-7,8-dimethyl-quinoline-4-carboxylic acid; N,N-diethylethanamine CAS Name: 2-(4-acetamidophenyl)-3-hydroxy-7,8-dimethyl-4-quinolinecarboxylic acid; N,N-diethylethanamine IUPAC Name: 2-(4-acetamidophenyl)-3-hydroxy-7,8-dimethylquinoline-4-carboxylic acid; N,N-diethylethanamine Traditional Name: 2-(4-acetamidophenyl)-3-hydroxy-7,8-dimethyl-cinchoninic acid; triethylamine Formula: C26H33N3O4 MolecularWeight: 451.55792

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC.CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)O)C3=CC=C(C=C3)NC(=O)C)C

Isomeric SMILES

CCN(CC)CC.CC1=C(C2=NC(=C(C(=C2C=C1)C(=O)O)O)C3=CC=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C20H18N2O4.C6H15N/c1-10-4-9-15-16(20(25)26)19(24)18(22-17(15)11(10)2)13-5-7-14(8-6-13)21-12(3)23;1-4-7(5-2)6-3/h4-9,24H,1-3H3,(H,21,23)(H,25,26);4-6H2,1-3H3