7-(3-chlorophenyl)-4-(quinoxalin-5-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol

Systemtic Name: 7-(3-chlorophenyl)-4-(quinoxalin-5-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Openeye Name: 7-(3-chlorophenyl)-4-(quinoxalin-5-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol CAS Name: 7-(3-chlorophenyl)-4-(5-quinoxalinylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol IUPAC Name: 7-(3-chlorophenyl)-4-(quinoxalin-5-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Traditional Name: 7-(3-chlorophenyl)-4-(quinoxalin-5-ylmethyl)-3,5-dihydro-2H-1,4-benzoxazepin-9-ol Formula: C24H20ClN3O2 MolecularWeight: 417.8875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(CN1CC3=C4C(=CC=C3)N=CC=N4)C=C(C=C2O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1COC2=C(CN1CC3=C4C(=CC=C3)N=CC=N4)C=C(C=C2O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C24H20ClN3O2/c25-20-5-1-3-16(12-20)18-11-19-15-28(9-10-30-24(19)22(29)13-18)14-17-4-2-6-21-23(17)27-8-7-26-21/h1-8,11-13,29H,9-10,14-15H2