N-(2-azanylethyl)-4-methoxy-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-azanylethyl)-4-methoxy-3-nitro-benzenesulfonamide Openeye Name: N-(2-aminoethyl)-4-methoxy-3-nitro-benzenesulfonamide CAS Name: N-(2-aminoethyl)-4-methoxy-3-nitrobenzenesulfonamide IUPAC Name: N-(2-aminoethyl)-4-methoxy-3-nitrobenzenesulfonamide Traditional Name: N-(2-aminoethyl)-4-methoxy-3-nitro-benzenesulfonamide Formula: C9H13N3O5S MolecularWeight: 275.28162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCN)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCN)[N+](=O)[O-]

InChI

InChI=1S/C9H13N3O5S/c1-17-9-3-2-7(6-8(9)12(13)14)18(15,16)11-5-4-10/h2-3,6,11H,4-5,10H2,1H3