N-[3-(azepan-1-yl)propyl]-2-[(4-methoxyphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-2-[(4-methoxyphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-2-(4-methoxyanilino)-4-quinolinecarboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-2-(4-methoxyanilino)quinoline-4-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-2-(p-anisidino)cinchoninamide Formula: C26H32N4O2 MolecularWeight: 432.55788

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C26H32N4O2/c1-32-21-13-11-20(12-14-21)28-25-19-23(22-9-4-5-10-24(22)29-25)26(31)27-15-8-18-30-16-6-2-3-7-17-30/h4-5,9-14,19H,2-3,6-8,15-18H2,1H3,(H,27,31)(H,28,29)