N-(2-diethylaminoethyl)-2-methyl-6-nitro-benzenesulfonamide

Systemtic Name: N-(2-diethylaminoethyl)-2-methyl-6-nitro-benzenesulfonamide Openeye Name: N-(2-diethylaminoethyl)-2-methyl-6-nitro-benzenesulfonamide CAS Name: N-(2-diethylaminoethyl)-2-methyl-6-nitrobenzenesulfonamide IUPAC Name: N-(2-diethylaminoethyl)-2-methyl-6-nitrobenzenesulfonamide Traditional Name: N-(2-diethylaminoethyl)-2-methyl-6-nitro-benzenesulfonamide Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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