3-[2-[(4-ethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]propyl-dimethyl-azanium

Systemtic Name: 3-[2-[(4-ethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(4-ethoxy-N-methylsulfonyl-anilino)acetyl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(4-ethoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(4-ethoxy-N-methylsulfonylanilino)acetyl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(4-ethoxy-N-mesyl-anilino)acetyl]amino]propyl-dimethyl-ammonium Formula: C16H28N3O4S+ MolecularWeight: 358.47622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC(=O)NCCC[NH+](C)C)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC(=O)NCCC[NH+](C)C)S(=O)(=O)C

InChI

InChI=1S/C16H27N3O4S/c1-5-23-15-9-7-14(8-10-15)19(24(4,21)22)13-16(20)17-11-6-12-18(2)3/h7-10H,5-6,11-13H2,1-4H3,(H,17,20)/p+1