2-(3-bromophenyl)-N,N-dipentyl-quinoline-4-carboxamide

Systemtic Name: 2-(3-bromophenyl)-N,N-dipentyl-quinoline-4-carboxamide Openeye Name: 2-(3-bromophenyl)-N,N-dipentyl-quinoline-4-carboxamide CAS Name: 2-(3-bromophenyl)-N,N-dipentyl-4-quinolinecarboxamide IUPAC Name: 2-(3-bromophenyl)-N,N-dipentylquinoline-4-carboxamide Traditional Name: N,N-diamyl-2-(3-bromophenyl)cinchoninamide Formula: C26H31BrN2O MolecularWeight: 467.44114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H31BrN2O/c1-3-5-9-16-29(17-10-6-4-2)26(30)23-19-25(20-12-11-13-21(27)18-20)28-24-15-8-7-14-22(23)24/h7-8,11-15,18-19H,3-6,9-10,16-17H2,1-2H3