N-[(2R)-2-(azocan-1-ium-1-yl)-2-phenyl-ethyl]-5-chloranyl-thiophene-2-sulfonamide

Systemtic Name: N-[(2R)-2-(azocan-1-ium-1-yl)-2-phenyl-ethyl]-5-chloranyl-thiophene-2-sulfonamide Openeye Name: N-[(2R)-2-(azocan-1-ium-1-yl)-2-phenyl-ethyl]-5-chloro-thiophene-2-sulfonamide CAS Name: N-[(2R)-2-(1-azocan-1-iumyl)-2-phenylethyl]-5-chloro-2-thiophenesulfonamide IUPAC Name: N-[(2R)-2-(azocan-1-ium-1-yl)-2-phenylethyl]-5-chlorothiophene-2-sulfonamide Traditional Name: N-[(2R)-2-(azocan-1-ium-1-yl)-2-phenyl-ethyl]-5-chloro-thiophene-2-sulfonamide Formula: C19H26ClN2O2S2+ MolecularWeight: 414.00494

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC[NH+](CCC1)C(CNS(=O)(=O)C2=CC=C(S2)Cl)C3=CC=CC=C3

Isomeric SMILES

C1CCC[NH+](CCC1)[C@@H](CNS(=O)(=O)C2=CC=C(S2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C19H25ClN2O2S2/c20-18-11-12-19(25-18)26(23,24)21-15-17(16-9-5-4-6-10-16)22-13-7-2-1-3-8-14-22/h4-6,9-12,17,21H,1-3,7-8,13-15H2/p+1/t17-/m0/s1