2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]quinoline-4-carboxamide

Systemtic Name: 2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]quinoline-4-carboxamide Openeye Name: 2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]quinoline-4-carboxamide CAS Name: 2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]quinoline-4-carboxamide Traditional Name: 2-(3,4-dimethylphenyl)-N-[3-(dipropylamino)propyl]cinchoninamide Formula: C27H35N3O MolecularWeight: 417.5863

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)C)C

Isomeric SMILES

CCCN(CCC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC(=C(C=C3)C)C

InChI

InChI=1S/C27H35N3O/c1-5-15-30(16-6-2)17-9-14-28-27(31)24-19-26(22-13-12-20(3)21(4)18-22)29-25-11-8-7-10-23(24)25/h7-8,10-13,18-19H,5-6,9,14-17H2,1-4H3,(H,28,31)