2-[(5-chloranylthiophen-2-yl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenecarboximidate

Systemtic Name: 2-[(5-chloranylthiophen-2-yl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenecarboximidate Openeye Name: 2-[(5-chloro-2-thienyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenecarboximidate CAS Name: 2-[(5-chloro-2-thiophenyl)sulfonylamino]-N-(2,2,6,6-tetramethyl-4-piperidin-1-iumyl)benzenecarboximidate IUPAC Name: 2-[(5-chlorothiophen-2-yl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenecarboximidate Traditional Name: 2-[(5-chloro-2-thienyl)sulfonylamino]-N-(2,2,6,6-tetramethylpiperidin-1-ium-4-yl)benzenecarboximidate Formula: C20H26ClN3O3S2 MolecularWeight: 456.02174

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CC([NH2+]1)(C)C)N=C(C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Cl)[O-])C

Isomeric SMILES

CC1(CC(CC([NH2+]1)(C)C)N=C(C2=CC=CC=C2NS(=O)(=O)C3=CC=C(S3)Cl)[O-])C

InChI

InChI=1S/C20H26ClN3O3S2/c1-19(2)11-13(12-20(3,4)24-19)22-18(25)14-7-5-6-8-15(14)23-29(26,27)17-10-9-16(21)28-17/h5-10,13,23-24H,11-12H2,1-4H3,(H,22,25)