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

Systemtic Name: (2S)-N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-1-ethanoyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-1-acetyl-N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]pyrrolidine-2-carboxamide CAS Name: (2S)-1-acetyl-N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-1-acetyl-N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]pyrrolidine-2-carboxamide Traditional Name: (2S)-1-acetyl-N-[2-(2-butyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl]pyrrolidine-2-carboxamide Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)C3CCCN3C(=O)C

Isomeric SMILES

CCCCC1CN(CC2=CC=CC=C2O1)CCNC(=O)[C@@H]3CCCN3C(=O)C

InChI

InChI=1S/C22H33N3O3/c1-3-4-9-19-16-24(15-18-8-5-6-11-21(18)28-19)14-12-23-22(27)20-10-7-13-25(20)17(2)26/h5-6,8,11,19-20H,3-4,7,9-10,12-16H2,1-2H3,(H,23,27)/t19?,20-/m0/s1