diethyl-[3-[naphthalen-2-ylsulfonyl(phenyl)amino]-2-oxidanyl-propyl]azanium chloride

Systemtic Name: diethyl-[3-[naphthalen-2-ylsulfonyl(phenyl)amino]-2-oxidanyl-propyl]azanium chloride Openeye Name: diethyl-[2-hydroxy-3-[N-(2-naphthylsulfonyl)anilino]propyl]ammonium chloride CAS Name: diethyl-[2-hydroxy-3-[N-(2-naphthalenylsulfonyl)anilino]propyl]ammonium chloride IUPAC Name: diethyl-[2-hydroxy-3-(N-naphthalen-2-ylsulfonylanilino)propyl]azanium chloride Traditional Name: diethyl-[2-hydroxy-3-[N-(2-naphthylsulfonyl)anilino]propyl]ammonium chloride Formula: C23H29ClN2O3S MolecularWeight: 449.00596

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(CN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)O.[Cl-]

Isomeric SMILES

CC[NH+](CC)CC(CN(C1=CC=CC=C1)S(=O)(=O)C2=CC3=CC=CC=C3C=C2)O.[Cl-]

InChI

InChI=1S/C23H28N2O3S.ClH/c1-3-24(4-2)17-22(26)18-25(21-12-6-5-7-13-21)29(27,28)23-15-14-19-10-8-9-11-20(19)16-23;/h5-16,22,26H,3-4,17-18H2,1-2H3;1H