2-ethoxy-4-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol

Systemtic Name: 2-ethoxy-4-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]phenol Openeye Name: 4-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-ethoxy-phenol CAS Name: 2-ethoxy-4-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]phenol IUPAC Name: 4-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-ethoxyphenol Traditional Name: 4-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-2-ethoxy-phenol Formula: C20H28N2O2+2 MolecularWeight: 328.44852

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C20H26N2O2/c1-2-24-20-14-18(8-9-19(20)23)16-22-12-10-21(11-13-22)15-17-6-4-3-5-7-17/h3-9,14,23H,2,10-13,15-16H2,1H3/p+2