azepan-1-yl-(2-pyridin-4-ylquinolin-4-yl)methanone

Systemtic Name: azepan-1-yl-(2-pyridin-4-ylquinolin-4-yl)methanone Openeye Name: azepan-1-yl-[2-(4-pyridyl)-4-quinolyl]methanone CAS Name: 1-azepanyl-(2-pyridin-4-yl-4-quinolinyl)methanone IUPAC Name: azepan-1-yl-(2-pyridin-4-ylquinolin-4-yl)methanone Traditional Name: azepan-1-yl-[2-(4-pyridyl)-4-quinolyl]methanone Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C21H21N3O/c25-21(24-13-5-1-2-6-14-24)18-15-20(16-9-11-22-12-10-16)23-19-8-4-3-7-17(18)19/h3-4,7-12,15H,1-2,5-6,13-14H2