N-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]ethanamide

Systemtic Name: N-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]ethanamide Openeye Name: N-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]acetamide CAS Name: N-[2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]acetamide IUPAC Name: N-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]acetamide Traditional Name: N-[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-ium-1-yl]ethyl]acetamide Formula: C16H26N3O5S+ MolecularWeight: 372.45974

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(=O)NCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H25N3O5S/c1-13(20)17-6-7-18-8-10-19(11-9-18)25(21,22)14-4-5-15(23-2)16(12-14)24-3/h4-5,12H,6-11H2,1-3H3,(H,17,20)/p+1