N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[(2S)-2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-piperonylamide Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCC[C@H]1CN(CC2=CC=CC=C2O1)CCNC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H28N2O4/c1-2-3-7-19-15-25(14-18-6-4-5-8-20(18)29-19)12-11-24-23(26)17-9-10-21-22(13-17)28-16-27-21/h4-6,8-10,13,19H,2-3,7,11-12,14-16H2,1H3,(H,24,26)/t19-/m0/s1