N-(2-diethylaminoethyl)-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-(2-diethylaminoethyl)-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-(2-diethylaminoethyl)-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-(2-diethylaminoethyl)-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-(2-diethylaminoethyl)-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-(2-diethylaminoethyl)-4-methyl-3-nitro-benzenesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)CCNS(=O)(=O)C1=CC(=C(C=C1)C)[N+](=O)[O-]

InChI

InChI=1S/C13H21N3O4S/c1-4-15(5-2)9-8-14-21(19,20)12-7-6-11(3)13(10-12)16(17)18/h6-7,10,14H,4-5,8-9H2,1-3H3