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

Systemtic Name: 3-[(2S)-8-chloranyl-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-(3-pyridin-3-yloxypropyl)propanamide Openeye Name: 3-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[3-(3-pyridyloxy)propyl]propanamide CAS Name: 3-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[3-(3-pyridinyloxy)propyl]propanamide IUPAC Name: 3-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-(3-pyridin-3-yloxypropyl)propanamide Traditional Name: 3-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[3-(3-pyridyloxy)propyl]propionamide Formula: C22H28ClN3O3 MolecularWeight: 417.92902

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=C(C=C2)Cl)CCC(=O)NCCCOC3=CN=CC=C3

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=C(C=C2)Cl)CCC(=O)NCCCOC3=CN=CC=C3

InChI

InChI=1S/C22H28ClN3O3/c1-2-19-16-26(15-17-6-7-18(23)13-21(17)29-19)11-8-22(27)25-10-4-12-28-20-5-3-9-24-14-20/h3,5-7,9,13-14,19H,2,4,8,10-12,15-16H2,1H3,(H,25,27)/t19-/m0/s1