N-(2-azanylethyl)-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-(2-azanylethyl)-3-chloranyl-4-methyl-5-nitro-benzenesulfonamide Openeye Name: N-(2-aminoethyl)-3-chloro-4-methyl-5-nitro-benzenesulfonamide CAS Name: N-(2-aminoethyl)-3-chloro-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-(2-aminoethyl)-3-chloro-4-methyl-5-nitrobenzenesulfonamide Traditional Name: N-(2-aminoethyl)-3-chloro-4-methyl-5-nitro-benzenesulfonamide Formula: C9H12ClN3O4S MolecularWeight: 293.72728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCCN)Cl

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])S(=O)(=O)NCCN)Cl

InChI

InChI=1S/C9H12ClN3O4S/c1-6-8(10)4-7(5-9(6)13(14)15)18(16,17)12-3-2-11/h4-5,12H,2-3,11H2,1H3