bis[2-[(4-methylphenyl)sulfonylamino]ethyl]-(phenylmethyl)azanium

Systemtic Name: bis[2-[(4-methylphenyl)sulfonylamino]ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-bis[2-(p-tolylsulfonylamino)ethyl]ammonium CAS Name: bis[2-[(4-methylphenyl)sulfonylamino]ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-bis[2-[(4-methylphenyl)sulfonylamino]ethyl]azanium Traditional Name: benzyl-bis[2-(tosylamino)ethyl]ammonium Formula: C25H32N3O4S2+ MolecularWeight: 502.66928

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+](CCNS(=O)(=O)C2=CC=C(C=C2)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCC[NH+](CCNS(=O)(=O)C2=CC=C(C=C2)C)CC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S2/c1-21-8-12-24(13-9-21)33(29,30)26-16-18-28(20-23-6-4-3-5-7-23)19-17-27-34(31,32)25-14-10-22(2)11-15-25/h3-15,26-27H,16-20H2,1-2H3/p+1