4-[4-[4-(6-chloranylpyridin-2-yl)piperidin-1-yl]butyl]-7-fluoranyl-3-methyl-1,4-benzoxazepin-5-one

Systemtic Name: 4-[4-[4-(6-chloranylpyridin-2-yl)piperidin-1-yl]butyl]-7-fluoranyl-3-methyl-1,4-benzoxazepin-5-one Openeye Name: 4-[4-[4-(6-chloro-2-pyridyl)-1-piperidyl]butyl]-7-fluoro-3-methyl-1,4-benzoxazepin-5-one CAS Name: 4-[4-[4-(6-chloro-2-pyridinyl)-1-piperidinyl]butyl]-7-fluoro-3-methyl-1,4-benzoxazepin-5-one IUPAC Name: 4-[4-[4-(6-chloropyridin-2-yl)piperidin-1-yl]butyl]-7-fluoro-3-methyl-1,4-benzoxazepin-5-one Traditional Name: 4-[4-[4-(6-chloro-2-pyridyl)piperidino]butyl]-7-fluoro-3-methyl-1,4-benzoxazepin-5-one Formula: C24H27ClFN3O2 MolecularWeight: 443.941483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClFN3O2/c1-17-16-31-22-8-7-19(26)15-20(22)24(30)29(17)12-3-2-11-28-13-9-18(10-14-28)21-5-4-6-23(25)27-21/h4-8,15-16,18H,2-3,9-14H2,1H3