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

Systemtic Name: (2S)-2-acetamido-N-[2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-methyl-pentanamide Openeye Name: (2S)-2-acetamido-N-[2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-methyl-pentanamide CAS Name: (2S)-2-acetamido-N-[2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-methylpentanamide IUPAC Name: (2S)-2-acetamido-N-[2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-methylpentanamide Traditional Name: (2S)-2-acetamido-N-[2-[(2S)-2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]ethyl]-4-methyl-valeramide Formula: C22H35N3O4 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CCNC(=O)C(CC(C)C)NC(=O)C

Isomeric SMILES

CC[C@H]1CN(CC2=C(O1)C=CC(=C2)OC)CCNC(=O)[C@H](CC(C)C)NC(=O)C

InChI

InChI=1S/C22H35N3O4/c1-6-18-14-25(13-17-12-19(28-5)7-8-21(17)29-18)10-9-23-22(27)20(11-15(2)3)24-16(4)26/h7-8,12,15,18,20H,6,9-11,13-14H2,1-5H3,(H,23,27)(H,24,26)/t18-,20-/m0/s1