methyl N-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]carbamate

Systemtic Name: methyl N-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]ethanoyl]carbamate Openeye Name: methyl N-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate CAS Name: N-[1-oxo-2-[4-(2,4,6-trimethylphenyl)sulfonyl-1-piperazin-1-iumyl]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(2,4,6-trimethylphenyl)sulfonylpiperazin-1-ium-1-yl]acetyl]carbamate Traditional Name: N-[2-(4-mesitylsulfonylpiperazin-1-ium-1-yl)acetyl]carbamic acid methyl ester Formula: C17H26N3O5S+ MolecularWeight: 384.47044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N3O5S/c1-12-9-13(2)16(14(3)10-12)26(23,24)20-7-5-19(6-8-20)11-15(21)18-17(22)25-4/h9-10H,5-8,11H2,1-4H3,(H,18,21,22)/p+1