methyl-tris[(3-sulfophenyl)methyl]azanium

Systemtic Name: methyl-tris[(3-sulfophenyl)methyl]azanium Openeye Name: methyl-tris[(3-sulfophenyl)methyl]ammonium CAS Name: methyl-tris[(3-sulfophenyl)methyl]ammonium IUPAC Name: methyl-tris[(3-sulfophenyl)methyl]azanium Traditional Name: methyl-tris(3-sulfobenzyl)ammonium Formula: C22H24NO9S3+ MolecularWeight: 542.62226

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](CC1=CC(=CC=C1)S(=O)(=O)O)(CC2=CC(=CC=C2)S(=O)(=O)O)CC3=CC(=CC=C3)S(=O)(=O)O

Isomeric SMILES

C[N+](CC1=CC(=CC=C1)S(=O)(=O)O)(CC2=CC(=CC=C2)S(=O)(=O)O)CC3=CC(=CC=C3)S(=O)(=O)O

InChI

InChI=1S/C22H23NO9S3/c1-23(14-17-5-2-8-20(11-17)33(24,25)26,15-18-6-3-9-21(12-18)34(27,28)29)16-19-7-4-10-22(13-19)35(30,31)32/h2-13H,14-16H2,1H3,(H2-,24,25,26,27,28,29,30,31,32)/p+1