3-(6-azanylhexyl)-8-chloranyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol

Systemtic Name: 3-(6-azanylhexyl)-8-chloranyl-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Openeye Name: 3-(6-aminohexyl)-8-chloro-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol CAS Name: 3-(6-aminohexyl)-8-chloro-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol IUPAC Name: 3-(6-aminohexyl)-8-chloro-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Traditional Name: 3-(6-aminohexyl)-8-chloro-5-phenyl-1,2,4,5-tetrahydro-3-benzazepin-7-ol Formula: C22H29ClN2O MolecularWeight: 372.93146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C2=CC(=C(C=C21)Cl)O)C3=CC=CC=C3)CCCCCCN

Isomeric SMILES

C1CN(CC(C2=CC(=C(C=C21)Cl)O)C3=CC=CC=C3)CCCCCCN

InChI

InChI=1S/C22H29ClN2O/c23-21-14-18-10-13-25(12-7-2-1-6-11-24)16-20(19(18)15-22(21)26)17-8-4-3-5-9-17/h3-5,8-9,14-15,20,26H,1-2,6-7,10-13,16,24H2