N-[4-[[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]methyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(2-phenylquinolin-4-yl)carbonyl-1,4-diazepan-1-yl]methyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide CAS Name: N-[4-[[4-[oxo-(2-phenyl-4-quinolinyl)methyl]-1,4-diazepan-1-yl]methyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Traditional Name: N-[4-[[4-(2-phenylquinoline-4-carbonyl)-1,4-diazepan-1-yl]methyl]phenyl]acetamide Formula: C30H30N4O2 MolecularWeight: 478.5848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C30H30N4O2/c1-22(35)31-25-14-12-23(13-15-25)21-33-16-7-17-34(19-18-33)30(36)27-20-29(24-8-3-2-4-9-24)32-28-11-6-5-10-26(27)28/h2-6,8-15,20H,7,16-19,21H2,1H3,(H,31,35)