N-[3-[butyl-(phenylmethyl)amino]propyl]-2-[(4-methoxyphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[3-[butyl-(phenylmethyl)amino]propyl]-2-[(4-methoxyphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[3-[benzyl(butyl)amino]propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide CAS Name: N-[3-[butyl-(phenylmethyl)amino]propyl]-2-(4-methoxyanilino)-4-quinolinecarboxamide IUPAC Name: N-[3-[benzyl(butyl)amino]propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide Traditional Name: N-[3-[benzyl(butyl)amino]propyl]-2-(p-anisidino)cinchoninamide Formula: C31H36N4O2 MolecularWeight: 496.64314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=C(C=C3)OC)CC4=CC=CC=C4

Isomeric SMILES

CCCCN(CCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC=C(C=C3)OC)CC4=CC=CC=C4

InChI

InChI=1S/C31H36N4O2/c1-3-4-20-35(23-24-11-6-5-7-12-24)21-10-19-32-31(36)28-22-30(34-29-14-9-8-13-27(28)29)33-25-15-17-26(37-2)18-16-25/h5-9,11-18,22H,3-4,10,19-21,23H2,1-2H3,(H,32,36)(H,33,34)