N-[3-(diethylamino)propyl]-2-phenyl-quinoline-4-carboxamide; 2-phenylquinoline-4-carboxylic acid

Systemtic Name: N-[3-(diethylamino)propyl]-2-phenyl-quinoline-4-carboxamide; 2-phenylquinoline-4-carboxylic acid Openeye Name: N-[3-(diethylamino)propyl]-2-phenyl-quinoline-4-carboxamide; 2-phenylquinoline-4-carboxylic acid CAS Name: N-[3-(diethylamino)propyl]-2-phenyl-4-quinolinecarboxamide; 2-phenyl-4-quinolinecarboxylic acid IUPAC Name: N-[3-(diethylamino)propyl]-2-phenylquinoline-4-carboxamide; 2-phenylquinoline-4-carboxylic acid Traditional Name: N-[3-(diethylamino)propyl]-2-phenyl-cinchoninamide; 2-phenylcinchoninic acid Formula: C39H38N4O3 MolecularWeight: 610.74402

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

Isomeric SMILES

CCN(CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=C3.C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)O

InChI

InChI=1S/C23H27N3O.C16H11NO2/c1-3-26(4-2)16-10-15-24-23(27)20-17-22(18-11-6-5-7-12-18)25-21-14-9-8-13-19(20)21;18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h5-9,11-14,17H,3-4,10,15-16H2,1-2H3,(H,24,27);1-10H,(H,18,19)