1-(4-ethanoyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one

Systemtic Name: 1-(4-ethanoyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-[1-(phenylmethyl)piperidin-4-yl]propan-1-one Openeye Name: 1-(4-acetyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-(1-benzyl-4-piperidyl)propan-1-one CAS Name: 1-(4-acetyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-[1-(phenylmethyl)-4-piperidinyl]-1-propanone IUPAC Name: 1-(4-acetyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-(1-benzylpiperidin-4-yl)propan-1-one Traditional Name: 1-(4-acetyl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)-3-(1-benzyl-4-piperidyl)propan-1-one Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCOC2=C(C1)C=C(C=C2)C(=O)CCC3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCOC2=C(C1)C=C(C=C2)C(=O)CCC3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H32N2O3/c1-20(29)28-15-16-31-26-10-8-23(17-24(26)19-28)25(30)9-7-21-11-13-27(14-12-21)18-22-5-3-2-4-6-22/h2-6,8,10,17,21H,7,9,11-16,18-19H2,1H3