2-(4-chlorophenyl)-N,N-dipentyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-chlorophenyl)-N,N-dipentyl-quinoline-4-carboxamide Openeye Name: 2-(4-chlorophenyl)-N,N-dipentyl-quinoline-4-carboxamide CAS Name: 2-(4-chlorophenyl)-N,N-dipentyl-4-quinolinecarboxamide IUPAC Name: 2-(4-chlorophenyl)-N,N-dipentylquinoline-4-carboxamide Traditional Name: N,N-diamyl-2-(4-chlorophenyl)cinchoninamide Formula: C26H31ClN2O MolecularWeight: 422.99014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCCN(CCCCC)C(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C26H31ClN2O/c1-3-5-9-17-29(18-10-6-4-2)26(30)23-19-25(20-13-15-21(27)16-14-20)28-24-12-8-7-11-22(23)24/h7-8,11-16,19H,3-6,9-10,17-18H2,1-2H3