4-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]butyl]-5H-1,4-benzoxazepin-3-one

Systemtic Name: 4-[4-[4-(4-chlorophenyl)-4-oxidanyl-piperidin-1-yl]butyl]-5H-1,4-benzoxazepin-3-one Openeye Name: 4-[4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidyl]butyl]-5H-1,4-benzoxazepin-3-one CAS Name: 4-[4-[4-(4-chlorophenyl)-4-hydroxy-1-piperidinyl]butyl]-5H-1,4-benzoxazepin-3-one IUPAC Name: 4-[4-[4-(4-chlorophenyl)-4-hydroxypiperidin-1-yl]butyl]-5H-1,4-benzoxazepin-3-one Traditional Name: 4-[4-[4-(4-chlorophenyl)-4-hydroxy-piperidino]butyl]-5H-1,4-benzoxazepin-3-one Formula: C24H29ClN2O3 MolecularWeight: 428.95166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCCN3CC4=CC=CC=C4OCC3=O

Isomeric SMILES

C1CN(CCC1(C2=CC=C(C=C2)Cl)O)CCCCN3CC4=CC=CC=C4OCC3=O

InChI

InChI=1S/C24H29ClN2O3/c25-21-9-7-20(8-10-21)24(29)11-15-26(16-12-24)13-3-4-14-27-17-19-5-1-2-6-22(19)30-18-23(27)28/h1-2,5-10,29H,3-4,11-18H2