N-[[4-(1-benzofuran-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-methyl-2-pyridin-2-yl-ethanamine

Systemtic Name: N-[[4-(1-benzofuran-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-methyl-2-pyridin-2-yl-ethanamine Openeye Name: N-[[4-(benzofuran-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-methyl-2-(2-pyridyl)ethanamine CAS Name: N-[[4-(2-benzofuranylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-methyl-2-(2-pyridinyl)ethanamine IUPAC Name: N-[[4-(1-benzofuran-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-methyl-2-pyridin-2-ylethanamine Traditional Name: [4-(benzofuran-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl-methyl-[2-(2-pyridyl)ethyl]amine Formula: C27H29N3O2 MolecularWeight: 427.53806

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=N1)CC2=CC3=C(C=C2)OCCN(C3)CC4=CC5=CC=CC=C5O4

Isomeric SMILES

CN(CCC1=CC=CC=N1)CC2=CC3=C(C=C2)OCCN(C3)CC4=CC5=CC=CC=C5O4

InChI

InChI=1S/C27H29N3O2/c1-29(13-11-24-7-4-5-12-28-24)18-21-9-10-26-23(16-21)19-30(14-15-31-26)20-25-17-22-6-2-3-8-27(22)32-25/h2-10,12,16-17H,11,13-15,18-20H2,1H3