bis(2-hydroxyethyl)-methyl-phenyl-azanium; 4-chloranylbenzenesulfonic acid

Systemtic Name: bis(2-hydroxyethyl)-methyl-phenyl-azanium; 4-chloranylbenzenesulfonic acid Openeye Name: bis(2-hydroxyethyl)-methyl-phenyl-ammonium; 4-chlorobenzenesulfonic acid CAS Name: bis(2-hydroxyethyl)-methyl-phenylammonium; 4-chlorobenzenesulfonic acid IUPAC Name: bis(2-hydroxyethyl)-methyl-phenylazanium; 4-chlorobenzenesulfonic acid Traditional Name: bis(2-hydroxyethyl)-methyl-phenyl-ammonium; 4-chlorobesylic acid Formula: C17H23ClNO5S+ MolecularWeight: 388.88622

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CCO)(CCO)C1=CC=CC=C1.C1=CC(=CC=C1S(=O)(=O)O)Cl

Isomeric SMILES

C[N+](CCO)(CCO)C1=CC=CC=C1.C1=CC(=CC=C1S(=O)(=O)O)Cl

InChI

InChI=1S/C11H18NO2.C6H5ClO3S/c1-12(7-9-13,8-10-14)11-5-3-2-4-6-11;7-5-1-3-6(4-2-5)11(8,9)10/h2-6,13-14H,7-10H2,1H3;1-4H,(H,8,9,10)/q+1;