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

Systemtic Name: 4-[4-(3-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 4-[4-[3-(2-pyridyl)-1-piperidyl]butyl]-1,4-benzoxazepin-5-one CAS Name: 4-[4-[3-(2-pyridinyl)-1-piperidinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 4-[4-(3-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 4-[4-[3-(2-pyridyl)piperidino]butyl]-1,4-benzoxazepin-5-one Formula: C23H27N3O2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O2/c27-23-20-9-1-2-11-22(20)28-17-16-26(23)15-6-5-13-25-14-7-8-19(18-25)21-10-3-4-12-24-21/h1-4,9-12,16-17,19H,5-8,13-15,18H2