2-(7-chloranyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-diethyl-ethanamine dihydrochloride

Systemtic Name: 2-(7-chloranyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-diethyl-ethanamine dihydrochloride Openeye Name: 2-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-diethyl-ethanamine dihydrochloride CAS Name: 2-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-diethylethanamine dihydrochloride IUPAC Name: 2-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-diethylethanamine dihydrochloride Traditional Name: 2-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)ethyl-diethyl-amine dihydrochloride Formula: C21H29Cl3N2O MolecularWeight: 431.82676

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl.Cl.Cl

Isomeric SMILES

CCN(CC)CCN1CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl.Cl.Cl

InChI

InChI=1S/C21H27ClN2O.2ClH/c1-3-23(4-2)12-13-24-14-15-25-20-11-10-18(22)16-19(20)21(24)17-8-6-5-7-9-17;;/h5-11,16,21H,3-4,12-15H2,1-2H3;2*1H