3-chloranyl-4-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-benzoxazepin-5-one

Systemtic Name: 3-chloranyl-4-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-benzoxazepin-5-one Openeye Name: 3-chloro-4-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-benzoxazepin-5-one CAS Name: 3-chloro-4-[3-(4-phenyl-1-piperazinyl)propyl]-1,4-benzoxazepin-5-one IUPAC Name: 3-chloro-4-[3-(4-phenylpiperazin-1-yl)propyl]-1,4-benzoxazepin-5-one Traditional Name: 3-chloro-4-[3-(4-phenylpiperazino)propyl]-1,4-benzoxazepin-5-one Formula: C22H24ClN3O2 MolecularWeight: 397.89786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCN2C(=COC3=CC=CC=C3C2=O)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H24ClN3O2/c23-21-17-28-20-10-5-4-9-19(20)22(27)26(21)12-6-11-24-13-15-25(16-14-24)18-7-2-1-3-8-18/h1-5,7-10,17H,6,11-16H2