N-(1,3-benzodioxol-5-ylmethyl)-2-[(2S)-8-chloranyl-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2S)-8-chloranyl-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]acetamide Traditional Name: 2-[(2S)-8-chloro-2-ethyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]-N-piperonyl-acetamide Formula: C21H23ClN2O4 MolecularWeight: 402.87132

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=C(C=C2)Cl)CC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=C(C=C2)Cl)CC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H23ClN2O4/c1-2-17-11-24(10-15-4-5-16(22)8-19(15)28-17)12-21(25)23-9-14-3-6-18-20(7-14)27-13-26-18/h3-8,17H,2,9-13H2,1H3,(H,23,25)/t17-/m0/s1