1-[(2-methoxy-4-phenylmethoxy-phenyl)methyl]-4-(phenylmethyl)piperazin-4-ium

Systemtic Name: 1-[(2-methoxy-4-phenylmethoxy-phenyl)methyl]-4-(phenylmethyl)piperazin-4-ium Openeye Name: 1-benzyl-4-[(4-benzyloxy-2-methoxy-phenyl)methyl]piperazin-1-ium CAS Name: 1-[(2-methoxy-4-phenylmethoxyphenyl)methyl]-4-(phenylmethyl)piperazin-4-ium IUPAC Name: 1-benzyl-4-[(2-methoxy-4-phenylmethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1-(4-benzoxy-2-methoxy-benzyl)-4-benzyl-piperazin-4-ium Formula: C26H31N2O2+ MolecularWeight: 403.53654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)OCC2=CC=CC=C2)CN3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C26H30N2O2/c1-29-26-18-25(30-21-23-10-6-3-7-11-23)13-12-24(26)20-28-16-14-27(15-17-28)19-22-8-4-2-5-9-22/h2-13,18H,14-17,19-21H2,1H3/p+1