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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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