7-chloranyl-4-[2-(4-methylpiperazin-1-yl)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride

Systemtic Name: 7-chloranyl-4-[2-(4-methylpiperazin-1-yl)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride Openeye Name: 7-chloro-4-[2-(4-methylpiperazin-1-yl)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride CAS Name: 7-chloro-4-[2-(4-methyl-1-piperazinyl)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride IUPAC Name: 7-chloro-4-[2-(4-methylpiperazin-1-yl)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride Traditional Name: 7-chloro-4-[2-(4-methylpiperazino)ethyl]-5-phenyl-3,5-dihydro-2H-1,4-benzoxazepine trihydrochloride Formula: C22H31Cl4N3O MolecularWeight: 495.31304

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCN2CCOC3=C(C2C4=CC=CC=C4)C=C(C=C3)Cl.Cl.Cl.Cl

Isomeric SMILES

CN1CCN(CC1)CCN2CCOC3=C(C2C4=CC=CC=C4)C=C(C=C3)Cl.Cl.Cl.Cl

InChI

InChI=1S/C22H28ClN3O.3ClH/c1-24-9-11-25(12-10-24)13-14-26-15-16-27-21-8-7-19(23)17-20(21)22(26)18-5-3-2-4-6-18;;;/h2-8,17,22H,9-16H2,1H3;3*1H