1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium

Systemtic Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium Openeye Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium CAS Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium IUPAC Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium Traditional Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-(2-methoxyphenyl)piperazin-1-ium Formula: C20H25N2O4+ MolecularWeight: 357.4235

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC4=C(C(=C3)OC)OCO4

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=CC4=C(C(=C3)OC)OCO4

InChI

InChI=1S/C20H24N2O4/c1-23-17-6-4-3-5-16(17)22-9-7-21(8-10-22)13-15-11-18(24-2)20-19(12-15)25-14-26-20/h3-6,11-12H,7-10,13-14H2,1-2H3/p+1