2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethylpiperidin-3-yl]methyl]ethanamide

Systemtic Name: 2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethylpiperidin-3-yl]methyl]ethanamide Openeye Name: 2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethyl-3-piperidyl]methyl]acetamide CAS Name: 2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethyl-3-piperidinyl]methyl]acetamide IUPAC Name: 2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethylpiperidin-3-yl]methyl]acetamide Traditional Name: 2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-[[(3S)-1-phenethyl-3-piperidyl]methyl]acetamide Formula: C28H39N3O3 MolecularWeight: 465.62756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC(=O)NCC3CCCN(C3)CCC4=CC=CC=C4

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=CC(=C2)OC)CC(=O)NC[C@@H]3CCCN(C3)CCC4=CC=CC=C4

InChI

InChI=1S/C28H39N3O3/c1-3-25-20-31(19-24-16-26(33-2)11-12-27(24)34-25)21-28(32)29-17-23-10-7-14-30(18-23)15-13-22-8-5-4-6-9-22/h4-6,8-9,11-12,16,23,25H,3,7,10,13-15,17-21H2,1-2H3,(H,29,32)/t23-,25-/m0/s1