2-[3-[azanyl(phenylsulfonyl)carbamoyl]pyridin-1-ium-1-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[3-[azanyl(phenylsulfonyl)carbamoyl]pyridin-1-ium-1-yl]-N-phenyl-ethanamide Openeye Name: 2-[3-[amino(benzenesulfonyl)carbamoyl]pyridin-1-ium-1-yl]-N-phenyl-acetamide CAS Name: 2-[3-[[amino(benzenesulfonyl)amino]-oxomethyl]-1-pyridin-1-iumyl]-N-phenylacetamide IUPAC Name: 2-[3-[amino(benzenesulfonyl)carbamoyl]pyridin-1-ium-1-yl]-N-phenylacetamide Traditional Name: 2-[3-[amino(besyl)carbamoyl]pyridin-1-ium-1-yl]-N-phenyl-acetamide Formula: C20H19N4O4S+ MolecularWeight: 411.45426

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N(N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C[N+]2=CC=CC(=C2)C(=O)N(N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H18N4O4S/c21-24(29(27,28)18-11-5-2-6-12-18)20(26)16-8-7-13-23(14-16)15-19(25)22-17-9-3-1-4-10-17/h1-14H,15,21H2/p+1