1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-propylsulfonyl-piperazin-1-ium

Systemtic Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-propylsulfonyl-piperazin-1-ium Openeye Name: 1-[(3-ethoxy-4-methoxy-phenyl)methyl]-4-propylsulfonyl-piperazin-1-ium CAS Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-propylsulfonylpiperazin-1-ium IUPAC Name: 1-[(3-ethoxy-4-methoxyphenyl)methyl]-4-propylsulfonylpiperazin-1-ium Traditional Name: 1-(3-ethoxy-4-methoxy-benzyl)-4-propylsulfonyl-piperazin-1-ium Formula: C17H29N2O4S+ MolecularWeight: 357.48816

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC[NH+](CC1)CC2=CC(=C(C=C2)OC)OCC

Isomeric SMILES

CCCS(=O)(=O)N1CC[NH+](CC1)CC2=CC(=C(C=C2)OC)OCC

InChI

InChI=1S/C17H28N2O4S/c1-4-12-24(20,21)19-10-8-18(9-11-19)14-15-6-7-16(22-3)17(13-15)23-5-2/h6-7,13H,4-5,8-12,14H2,1-3H3/p+1