3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(2-pyridin-2-ylpiperidin-1-yl)propan-1-one

Systemtic Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(2-pyridin-2-ylpiperidin-1-yl)propan-1-one Openeye Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(2-pyridyl)-1-piperidyl]propan-1-one CAS Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(2-pyridinyl)-1-piperidinyl]-1-propanone IUPAC Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-(2-pyridin-2-ylpiperidin-1-yl)propan-1-one Traditional Name: 3-(2-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-[2-(2-pyridyl)piperidino]propan-1-one Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CC=CC=N2)C(=O)CCN3CC(OC4=CC=CC=C4C3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C(C1)C2=CC=CC=N2)C(=O)CCN3CC(OC4=CC=CC=C4C3)C5=CC=CC=C5

InChI

InChI=1S/C28H31N3O2/c32-28(31-18-9-7-14-25(31)24-13-6-8-17-29-24)16-19-30-20-23-12-4-5-15-26(23)33-27(21-30)22-10-2-1-3-11-22/h1-6,8,10-13,15,17,25,27H,7,9,14,16,18-21H2