2-[4-(8-oxidanylquinolin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[4-(8-oxidanylquinolin-2-yl)carbonyl-1,4-diazepan-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[4-(8-hydroxyquinoline-2-carbonyl)-1,4-diazepan-1-yl]-N-phenyl-acetamide CAS Name: 2-[4-[(8-hydroxy-2-quinolinyl)-oxomethyl]-1,4-diazepan-1-yl]-N-phenylacetamide IUPAC Name: 2-[4-(8-hydroxyquinoline-2-carbonyl)-1,4-diazepan-1-yl]-N-phenylacetamide Traditional Name: 2-[4-(8-hydroxyquinoline-2-carbonyl)-1,4-diazepan-1-yl]-N-phenyl-acetamide Formula: C23H24N4O3 MolecularWeight: 404.46166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NC3=C(C=CC=C3O)C=C2)CC(=O)NC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NC3=C(C=CC=C3O)C=C2)CC(=O)NC4=CC=CC=C4

InChI

InChI=1S/C23H24N4O3/c28-20-9-4-6-17-10-11-19(25-22(17)20)23(30)27-13-5-12-26(14-15-27)16-21(29)24-18-7-2-1-3-8-18/h1-4,6-11,28H,5,12-16H2,(H,24,29)