1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-phenylpropyl)piperazin-1-ium

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-phenylpropyl)piperazin-1-ium Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-phenylpropyl)piperazin-1-ium CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-phenylpropyl)piperazin-1-ium IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-4-(3-phenylpropyl)piperazin-1-ium Traditional Name: 1-homoveratryl-4-(3-phenylpropyl)piperazin-1-ium Formula: C23H33N2O2+ MolecularWeight: 369.52032

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC[NH+]2CCN(CC2)CCCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC[NH+]2CCN(CC2)CCCC3=CC=CC=C3)OC

InChI

InChI=1S/C23H32N2O2/c1-26-22-11-10-21(19-23(22)27-2)12-14-25-17-15-24(16-18-25)13-6-9-20-7-4-3-5-8-20/h3-5,7-8,10-11,19H,6,9,12-18H2,1-2H3/p+1