2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]-6-methyl-quinoline-4-carboxamide

Systemtic Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]-6-methyl-quinoline-4-carboxamide Openeye Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]-6-methyl-quinoline-4-carboxamide CAS Name: 2-(4-acetamidophenyl)-N-[3-(1-azepanyl)propyl]-6-methyl-4-quinolinecarboxamide IUPAC Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]-6-methylquinoline-4-carboxamide Traditional Name: 2-(4-acetamidophenyl)-N-[3-(azepan-1-yl)propyl]-6-methyl-cinchoninamide Formula: C28H34N4O2 MolecularWeight: 458.59516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCCN3CCCCCC3)C4=CC=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NCCCN3CCCCCC3)C4=CC=C(C=C4)NC(=O)C

InChI

InChI=1S/C28H34N4O2/c1-20-8-13-26-24(18-20)25(28(34)29-14-7-17-32-15-5-3-4-6-16-32)19-27(31-26)22-9-11-23(12-10-22)30-21(2)33/h8-13,18-19H,3-7,14-17H2,1-2H3,(H,29,34)(H,30,33)