3-(diphenylmethyl)-1-[[2-methoxy-5-(1,2,3,4-tetrazol-1-yl)phenyl]methyl]piperazine dihydrochloride

Systemtic Name: 3-(diphenylmethyl)-1-[[2-methoxy-5-(1,2,3,4-tetrazol-1-yl)phenyl]methyl]piperazine dihydrochloride Openeye Name: 3-benzhydryl-1-[[2-methoxy-5-(tetrazol-1-yl)phenyl]methyl]piperazine dihydrochloride CAS Name: 3-(diphenylmethyl)-1-[[2-methoxy-5-(1-tetrazolyl)phenyl]methyl]piperazine dihydrochloride IUPAC Name: 3-benzhydryl-1-[[2-methoxy-5-(tetrazol-1-yl)phenyl]methyl]piperazine dihydrochloride Traditional Name: 3-benzhydryl-1-[2-methoxy-5-(tetrazol-1-yl)benzyl]piperazine dihydrochloride Formula: C26H30Cl2N6O MolecularWeight: 513.462

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C=NN=N2)CN3CCNC(C3)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

Isomeric SMILES

COC1=C(C=C(C=C1)N2C=NN=N2)CN3CCNC(C3)C(C4=CC=CC=C4)C5=CC=CC=C5.Cl.Cl

InChI

InChI=1S/C26H28N6O.2ClH/c1-33-25-13-12-23(32-19-28-29-30-32)16-22(25)17-31-15-14-27-24(18-31)26(20-8-4-2-5-9-20)21-10-6-3-7-11-21;;/h2-13,16,19,24,26-27H,14-15,17-18H2,1H3;2*1H