(8-oxidanylquinolin-2-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (8-oxidanylquinolin-2-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (8-hydroxy-2-quinolyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (8-hydroxy-2-quinolinyl)-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (8-hydroxyquinolin-2-yl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (8-hydroxy-2-quinolyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone Formula: C21H22N4O2 MolecularWeight: 362.42498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=NC3=C(C=CC=C3O)C=C2)CC4=CC=CC=N4

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=NC3=C(C=CC=C3O)C=C2)CC4=CC=CC=N4

InChI

InChI=1S/C21H22N4O2/c26-19-7-3-5-16-8-9-18(23-20(16)19)21(27)25-12-4-11-24(13-14-25)15-17-6-1-2-10-22-17/h1-3,5-10,26H,4,11-15H2