N-[3-(azepan-1-ylcarbonyl)phenyl]-6-methyl-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-[3-(azepan-1-ylcarbonyl)phenyl]-6-methyl-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[3-(azepane-1-carbonyl)phenyl]-6-methyl-2-phenyl-quinoline-4-carboxamide CAS Name: N-[3-[1-azepanyl(oxo)methyl]phenyl]-6-methyl-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[3-(azepane-1-carbonyl)phenyl]-6-methyl-2-phenylquinoline-4-carboxamide Traditional Name: N-[3-(azepane-1-carbonyl)phenyl]-6-methyl-2-phenyl-cinchoninamide Formula: C30H29N3O2 MolecularWeight: 463.57016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=CC=CC(=C3)C(=O)N4CCCCCC4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=CC=CC(=C3)C(=O)N4CCCCCC4)C5=CC=CC=C5

InChI

InChI=1S/C30H29N3O2/c1-21-14-15-27-25(18-21)26(20-28(32-27)22-10-5-4-6-11-22)29(34)31-24-13-9-12-23(19-24)30(35)33-16-7-2-3-8-17-33/h4-6,9-15,18-20H,2-3,7-8,16-17H2,1H3,(H,31,34)