4-(7-chloranyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-butan-1-amine dihydrochloride

Systemtic Name: 4-(7-chloranyl-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-butan-1-amine dihydrochloride Openeye Name: 4-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-butan-1-amine dihydrochloride CAS Name: 4-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethyl-1-butanamine dihydrochloride IUPAC Name: 4-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-N,N-dimethylbutan-1-amine dihydrochloride Traditional Name: 4-(7-chloro-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepin-4-yl)butyl-dimethyl-amine dihydrochloride Formula: C21H29Cl3N2O MolecularWeight: 431.82676

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCCN1CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl.Cl.Cl

Isomeric SMILES

CN(C)CCCCN1CCOC2=C(C1C3=CC=CC=C3)C=C(C=C2)Cl.Cl.Cl

InChI

InChI=1S/C21H27ClN2O.2ClH/c1-23(2)12-6-7-13-24-14-15-25-20-11-10-18(22)16-19(20)21(24)17-8-4-3-5-9-17;;/h3-5,8-11,16,21H,6-7,12-15H2,1-2H3;2*1H