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

Systemtic Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]quinoline-4-carboxamide Openeye Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]quinoline-4-carboxamide CAS Name: 2-(4-acetamidophenyl)-N-[3-(1-azepanyl)propyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]quinoline-4-carboxamide Traditional Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]cinchoninamide Formula: C27H32N4O2 MolecularWeight: 444.56858

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCCCCC4

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4CCCCCC4

InChI

InChI=1S/C27H32N4O2/c1-20(32)29-22-13-11-21(12-14-22)26-19-24(23-9-4-5-10-25(23)30-26)27(33)28-15-8-18-31-16-6-2-3-7-17-31/h4-5,9-14,19H,2-3,6-8,15-18H2,1H3,(H,28,33)(H,29,32)