(2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine

Systemtic Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine Openeye Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine CAS Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine IUPAC Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine Traditional Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2,7-dimethyl-3,5-dihydro-2H-1,4-benzoxazepine Formula: C15H19N3O MolecularWeight: 257.33086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC2=C(O1)C=CC(=C2)C)CC3=NC=CN3

Isomeric SMILES

C[C@H]1CN(CC2=C(O1)C=CC(=C2)C)CC3=NC=CN3

InChI

InChI=1S/C15H19N3O/c1-11-3-4-14-13(7-11)9-18(8-12(2)19-14)10-15-16-5-6-17-15/h3-7,12H,8-10H2,1-2H3,(H,16,17)/t12-/m0/s1