4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methyl-but-3-yn-2-ol

Systemtic Name: 4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methyl-but-3-yn-2-ol Openeye Name: 4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methyl-but-3-yn-2-ol CAS Name: 4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methyl-3-butyn-2-ol IUPAC Name: 4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methylbut-3-yn-2-ol Traditional Name: 4-[4-[(2-ethyl-7-methoxy-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)methyl]phenyl]-2-methyl-but-3-yn-2-ol Formula: C24H29NO3 MolecularWeight: 379.49196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC3=CC=C(C=C3)C#CC(C)(C)O

Isomeric SMILES

CCC1CN(CC2=C(O1)C=CC(=C2)OC)CC3=CC=C(C=C3)C#CC(C)(C)O

InChI

InChI=1S/C24H29NO3/c1-5-21-17-25(16-20-14-22(27-4)10-11-23(20)28-21)15-19-8-6-18(7-9-19)12-13-24(2,3)26/h6-11,14,21,26H,5,15-17H2,1-4H3