ethyl 2-[3-(phenylsulfonylaminocarbamoyl)pyridin-1-ium-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-(phenylsulfonylaminocarbamoyl)pyridin-1-ium-1-yl]ethanoate Openeye Name: ethyl 2-[3-(benzenesulfonamidocarbamoyl)pyridin-1-ium-1-yl]acetate CAS Name: 2-[3-[(benzenesulfonylhydrazo)-oxomethyl]-1-pyridin-1-iumyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(benzenesulfonamidocarbamoyl)pyridin-1-ium-1-yl]acetate Traditional Name: 2-[3-(benzenesulfonamidocarbamoyl)pyridin-1-ium-1-yl]acetic acid ethyl ester Formula: C16H18N3O5S+ MolecularWeight: 364.39622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NNS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C[N+]1=CC=CC(=C1)C(=O)NNS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C16H17N3O5S/c1-2-24-15(20)12-19-10-6-7-13(11-19)16(21)17-18-25(22,23)14-8-4-3-5-9-14/h3-11,18H,2,12H2,1H3/p+1