6-bromanyl-N-[1-(dipentylamino)propan-2-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[1-(dipentylamino)propan-2-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[2-(dipentylamino)-1-methyl-ethyl]-2-(4-ethylphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[1-(dipentylamino)propan-2-yl]-2-(4-ethylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[1-(dipentylamino)propan-2-yl]-2-(4-ethylphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[2-(diamylamino)-1-methyl-ethyl]-2-(4-ethylphenyl)cinchoninamide Formula: C31H42BrN3O MolecularWeight: 552.58868

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC(C)NC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)CC

Isomeric SMILES

CCCCCN(CCCCC)CC(C)NC(=O)C1=CC(=NC2=C1C=C(C=C2)Br)C3=CC=C(C=C3)CC

InChI

InChI=1S/C31H42BrN3O/c1-5-8-10-18-35(19-11-9-6-2)22-23(4)33-31(36)28-21-30(25-14-12-24(7-3)13-15-25)34-29-17-16-26(32)20-27(28)29/h12-17,20-21,23H,5-11,18-19,22H2,1-4H3,(H,33,36)