4-chloranyl-N-(2-morpholin-4-ium-4-ylethyl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-morpholin-4-ium-4-ylethyl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[2-(4-morpholin-4-iumyl)ethyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(2-morpholin-4-ium-4-ylethyl)-3-nitro-benzenesulfonamide Formula: C12H17ClN3O5S+ MolecularWeight: 350.79848

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H16ClN3O5S/c13-11-2-1-10(9-12(11)16(17)18)22(19,20)14-3-4-15-5-7-21-8-6-15/h1-2,9,14H,3-8H2/p+1