3-chloranyl-4-[4-(3-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3-chloranyl-4-[4-(3-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 3-chloro-4-[4-[3-(2-pyridyl)-1-piperidyl]butyl]-1,4-benzoxazepin-5-one CAS Name: 3-chloro-4-[4-[3-(2-pyridinyl)-1-piperidinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 3-chloro-4-[4-(3-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 3-chloro-4-[4-[3-(2-pyridyl)piperidino]butyl]-1,4-benzoxazepin-5-one Formula: C23H26ClN3O2 MolecularWeight: 411.92444

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CCCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=CC=CC=N4

Isomeric SMILES

C1CC(CN(C1)CCCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=CC=CC=N4

InChI

InChI=1S/C23H26ClN3O2/c24-22-17-29-21-11-2-1-9-19(21)23(28)27(22)15-6-5-13-26-14-7-8-18(16-26)20-10-3-4-12-25-20/h1-4,9-12,17-18H,5-8,13-16H2