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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=CC=N2)CCCCN3C(=COC4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1CN(CCC1C2=CC=CC=N2)CCCCN3C(=COC4=CC=CC=C4C3=O)Cl

InChI

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