4-[4-[4-(4-chlorophenyl)piperidin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione

Systemtic Name: 4-[4-[4-(4-chlorophenyl)piperidin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione Openeye Name: 4-[4-[4-(4-chlorophenyl)-1-piperidyl]butyl]-1,4-benzoxazepine-3,5-dione CAS Name: 4-[4-[4-(4-chlorophenyl)-1-piperidinyl]butyl]-1,4-benzoxazepine-3,5-dione IUPAC Name: 4-[4-[4-(4-chlorophenyl)piperidin-1-yl]butyl]-1,4-benzoxazepine-3,5-dione Traditional Name: 4-[4-[4-(4-chlorophenyl)piperidino]butyl]-1,4-benzoxazepine-3,5-quinone Formula: C24H27ClN2O3 MolecularWeight: 426.93578

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CC=C(C=C2)Cl)CCCCN3C(=O)COC4=CC=CC=C4C3=O

Isomeric SMILES

C1CN(CCC1C2=CC=C(C=C2)Cl)CCCCN3C(=O)COC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27ClN2O3/c25-20-9-7-18(8-10-20)19-11-15-26(16-12-19)13-3-4-14-27-23(28)17-30-22-6-2-1-5-21(22)24(27)29/h1-2,5-10,19H,3-4,11-17H2