2-methoxy-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]phenol

Systemtic Name: 2-methoxy-4-[[4-(phenylmethyl)piperazin-1-ium-1-yl]methyl]phenol Openeye Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methoxy-phenol CAS Name: 2-methoxy-4-[[4-(phenylmethyl)-1-piperazin-1-iumyl]methyl]phenol IUPAC Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methoxyphenol Traditional Name: 4-[(4-benzylpiperazin-1-ium-1-yl)methyl]-2-methoxy-phenol Formula: C19H25N2O2+ MolecularWeight: 313.414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C[NH+]2CCN(CC2)CC3=CC=CC=C3)O

Isomeric SMILES

COC1=C(C=CC(=C1)C[NH+]2CCN(CC2)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H24N2O2/c1-23-19-13-17(7-8-18(19)22)15-21-11-9-20(10-12-21)14-16-5-3-2-4-6-16/h2-8,13,22H,9-12,14-15H2,1H3/p+1