1-[(2,5-dimethoxyphenyl)methyl]-4-(diphenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(diphenylmethyl)piperazine-1,4-diium Openeye Name: 1-benzhydryl-4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium CAS Name: 1-[(2,5-dimethoxyphenyl)methyl]-4-(diphenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzhydryl-4-[(2,5-dimethoxyphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-benzhydryl-4-(2,5-dimethoxybenzyl)piperazine-1,4-diium Formula: C26H32N2O2+2 MolecularWeight: 404.54448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N2O2/c1-29-24-13-14-25(30-2)23(19-24)20-27-15-17-28(18-16-27)26(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-14,19,26H,15-18,20H2,1-2H3/p+2