4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol

Systemtic Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol CAS Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 4-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 4-[4-(2,5-dimethoxybenzyl)piperazin-4-ium-1-yl]phenol Formula: C19H25N2O3+ MolecularWeight: 329.4134

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24N2O3/c1-23-18-7-8-19(24-2)15(13-18)14-20-9-11-21(12-10-20)16-3-5-17(22)6-4-16/h3-8,13,22H,9-12,14H2,1-2H3/p+1