3-[(2S)-7-chloranyl-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-ethanoylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[(2S)-7-chloranyl-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-ethanoylpiperazin-1-yl)propan-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-3-[(2S)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-3-[(2S)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-propanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-3-[(2S)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one Traditional Name: 1-(4-acetylpiperazino)-3-[(2S)-7-chloro-2-methyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one Formula: C19H26ClN3O3 MolecularWeight: 379.88104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=CC(=C2)Cl)CCC(=O)N3CCN(CC3)C(=O)C

Isomeric SMILES

C[C@H]1CN(CC2=C(O1)C=CC(=C2)Cl)CCC(=O)N3CCN(CC3)C(=O)C

InChI

InChI=1S/C19H26ClN3O3/c1-14-12-21(13-16-11-17(20)3-4-18(16)26-14)6-5-19(25)23-9-7-22(8-10-23)15(2)24/h3-4,11,14H,5-10,12-13H2,1-2H3/t14-/m0/s1