1-(4-ethoxyphenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium

Systemtic Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium Openeye Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium CAS Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium IUPAC Name: 1-(4-ethoxyphenyl)sulfonyl-4-[(2-methoxyphenyl)methyl]piperazin-4-ium Traditional Name: 1-o-anisyl-4-p-phenetylsulfonyl-piperazin-1-ium Formula: C20H27N2O4S+ MolecularWeight: 391.50438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=C3OC

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CC[NH+](CC2)CC3=CC=CC=C3OC

InChI

InChI=1S/C20H26N2O4S/c1-3-26-18-8-10-19(11-9-18)27(23,24)22-14-12-21(13-15-22)16-17-6-4-5-7-20(17)25-2/h4-11H,3,12-16H2,1-2H3/p+1