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

Systemtic Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol Openeye Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol CAS Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazin-4-iumyl]phenol IUPAC Name: 2-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-4-ium-1-yl]phenol Traditional Name: 2-[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=CC=C3O

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C[NH+]2CCN(CC2)C3=CC=CC=C3O

InChI

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