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

Systemtic Name: 7-fluoranyl-3-methyl-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Openeye Name: 7-fluoro-3-methyl-4-[4-[4-(2-pyridyl)-1-piperidyl]butyl]-1,4-benzoxazepin-5-one CAS Name: 7-fluoro-3-methyl-4-[4-[4-(2-pyridinyl)-1-piperidinyl]butyl]-1,4-benzoxazepin-5-one IUPAC Name: 7-fluoro-3-methyl-4-[4-(4-pyridin-2-ylpiperidin-1-yl)butyl]-1,4-benzoxazepin-5-one Traditional Name: 7-fluoro-3-methyl-4-[4-[4-(2-pyridyl)piperidino]butyl]-1,4-benzoxazepin-5-one Formula: C24H28FN3O2 MolecularWeight: 409.496423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C=C(C=C2)F)C(=O)N1CCCCN3CCC(CC3)C4=CC=CC=N4

Isomeric SMILES

CC1=COC2=C(C=C(C=C2)F)C(=O)N1CCCCN3CCC(CC3)C4=CC=CC=N4

InChI

InChI=1S/C24H28FN3O2/c1-18-17-30-23-8-7-20(25)16-21(23)24(29)28(18)13-5-4-12-27-14-9-19(10-15-27)22-6-2-3-11-26-22/h2-3,6-8,11,16-17,19H,4-5,9-10,12-15H2,1H3