[(2R)-1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]-piperidin-1-ylsulfonyl-propyl-azanium

Systemtic Name: [(2R)-1-[(3-chlorophenyl)amino]-1-oxidanylidene-propan-2-yl]-piperidin-1-ylsulfonyl-propyl-azanium Openeye Name: [(1R)-2-(3-chloroanilino)-1-methyl-2-oxo-ethyl]-(1-piperidylsulfonyl)-propyl-ammonium CAS Name: [(2R)-1-(3-chloroanilino)-1-oxopropan-2-yl]-(1-piperidinylsulfonyl)-propylammonium IUPAC Name: [(2R)-1-(3-chloroanilino)-1-oxopropan-2-yl]-piperidin-1-ylsulfonyl-propylazanium Traditional Name: [(1R)-2-(3-chloroanilino)-2-keto-1-methyl-ethyl]-piperidinosulfonyl-propyl-ammonium Formula: C17H27ClN3O3S+ MolecularWeight: 388.93258

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](C(C)C(=O)NC1=CC(=CC=C1)Cl)S(=O)(=O)N2CCCCC2

Isomeric SMILES

CCC[NH+]([C@H](C)C(=O)NC1=CC(=CC=C1)Cl)S(=O)(=O)N2CCCCC2

InChI

InChI=1S/C17H26ClN3O3S/c1-3-10-21(25(23,24)20-11-5-4-6-12-20)14(2)17(22)19-16-9-7-8-15(18)13-16/h7-9,13-14H,3-6,10-12H2,1-2H3,(H,19,22)/p+1/t14-/m1/s1