[2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl]-ethyl-[2-[(3-methylsulfonylphenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl]-ethyl-[2-(3-methylsulfonylanilino)-2-oxo-ethyl]ammonium CAS Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]ammonium IUPAC Name: [2-(tert-butylamino)-2-oxoethyl]-ethyl-[2-(3-methylsulfonylanilino)-2-oxoethyl]azanium Traditional Name: [2-(tert-butylamino)-2-keto-ethyl]-ethyl-[2-keto-2-(3-mesylanilino)ethyl]ammonium Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=CC(=CC=C1)S(=O)(=O)C)CC(=O)NC(C)(C)C

Isomeric SMILES

CC[NH+](CC(=O)NC1=CC(=CC=C1)S(=O)(=O)C)CC(=O)NC(C)(C)C

InChI

InChI=1S/C17H27N3O4S/c1-6-20(12-16(22)19-17(2,3)4)11-15(21)18-13-8-7-9-14(10-13)25(5,23)24/h7-10H,6,11-12H2,1-5H3,(H,18,21)(H,19,22)/p+1