2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)carbonylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[4-chloro-3-(1-piperidylsulfonyl)benzoyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-oxomethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(4-chloro-3-piperidin-1-ylsulfonylbenzoyl)amino]ethyl-dimethylazanium Traditional Name: 2-[(4-chloro-3-piperidinosulfonyl-benzoyl)amino]ethyl-dimethyl-ammonium Formula: C16H25ClN3O3S+ MolecularWeight: 374.906

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCC2

Isomeric SMILES

C[NH+](C)CCNC(=O)C1=CC(=C(C=C1)Cl)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C16H24ClN3O3S/c1-19(2)11-8-18-16(21)13-6-7-14(17)15(12-13)24(22,23)20-9-4-3-5-10-20/h6-7,12H,3-5,8-11H2,1-2H3,(H,18,21)/p+1