N-tert-butyl-2-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-tert-butyl-2-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-tert-butyl-2-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-tert-butyl-2-[4-(2-methoxy-5-methylphenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-tert-butyl-2-[4-(2-methoxy-5-methylphenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-tert-butyl-2-[4-(2-methoxy-5-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C18H30N3O4S+ MolecularWeight: 384.5135

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CC[NH+](CC2)CC(=O)NC(C)(C)C

InChI

InChI=1S/C18H29N3O4S/c1-14-6-7-15(25-5)16(12-14)26(23,24)21-10-8-20(9-11-21)13-17(22)19-18(2,3)4/h6-7,12H,8-11,13H2,1-5H3,(H,19,22)/p+1