2-[(2S)-8-chloranyl-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-pyridin-4-ylpiperidin-1-yl)ethanone

Systemtic Name: 2-[(2S)-8-chloranyl-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-pyridin-4-ylpiperidin-1-yl)ethanone Openeye Name: 2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[4-(4-pyridyl)-1-piperidyl]ethanone CAS Name: 2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-pyridin-4-yl-1-piperidinyl)ethanone IUPAC Name: 2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-(4-pyridin-4-ylpiperidin-1-yl)ethanone Traditional Name: 2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-1-[4-(4-pyridyl)piperidino]ethanone Formula: C23H28ClN3O2 MolecularWeight: 413.94032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=C(C=C2)Cl)CC(=O)N3CCC(CC3)C4=CC=NC=C4

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=C(C=C2)Cl)CC(=O)N3CCC(CC3)C4=CC=NC=C4

InChI

InChI=1S/C23H28ClN3O2/c1-2-21-15-26(14-19-3-4-20(24)13-22(19)29-21)16-23(28)27-11-7-18(8-12-27)17-5-9-25-10-6-17/h3-6,9-10,13,18,21H,2,7-8,11-12,14-16H2,1H3/t21-/m0/s1