2-[4-(1-benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)propan-2-ol

Systemtic Name: 2-[4-(1-benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)propan-2-ol Openeye Name: 2-[4-(benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)propan-2-ol CAS Name: 2-[4-(1-benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)-2-propanol IUPAC Name: 2-[4-(1-benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)propan-2-ol Traditional Name: 2-[4-(benzothiophen-2-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-(dimethylamino)propan-2-ol Formula: C23H28N2O2S MolecularWeight: 396.54562

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN(C)C)(C1=CC2=C(C=C1)OCCN(C2)CC3=CC4=CC=CC=C4S3)O

Isomeric SMILES

CC(CN(C)C)(C1=CC2=C(C=C1)OCCN(C2)CC3=CC4=CC=CC=C4S3)O

InChI

InChI=1S/C23H28N2O2S/c1-23(26,16-24(2)3)19-8-9-21-18(12-19)14-25(10-11-27-21)15-20-13-17-6-4-5-7-22(17)28-20/h4-9,12-13,26H,10-11,14-16H2,1-3H3