1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)piperazin-1-ium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)piperazin-1-ium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(4-methoxyphenyl)piperazin-1-ium Traditional Name: 1-(4-methoxyphenyl)-4-piperonyl-piperazin-4-ium Formula: C19H23N2O3+ MolecularWeight: 327.39752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=CC=C(C=C1)N2CC[NH+](CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H22N2O3/c1-22-17-5-3-16(4-6-17)21-10-8-20(9-11-21)13-15-2-7-18-19(12-15)24-14-23-18/h2-7,12H,8-11,13-14H2,1H3/p+1