N-(2-dimethylaminoethyl)-N-methyl-3-nitro-4-(2-nitropropan-2-yl)benzenesulfonamide

Systemtic Name: N-(2-dimethylaminoethyl)-N-methyl-3-nitro-4-(2-nitropropan-2-yl)benzenesulfonamide Openeye Name: N-(2-dimethylaminoethyl)-N-methyl-4-(1-methyl-1-nitro-ethyl)-3-nitro-benzenesulfonamide CAS Name: N-(2-dimethylaminoethyl)-N-methyl-3-nitro-4-(2-nitropropan-2-yl)benzenesulfonamide IUPAC Name: N-(2-dimethylaminoethyl)-N-methyl-3-nitro-4-(2-nitropropan-2-yl)benzenesulfonamide Traditional Name: N-(2-dimethylaminoethyl)-N-methyl-4-(1-methyl-1-nitro-ethyl)-3-nitro-benzenesulfonamide Formula: C14H22N4O6S MolecularWeight: 374.41268

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O6S/c1-14(2,18(21)22)12-7-6-11(10-13(12)17(19)20)25(23,24)16(5)9-8-15(3)4/h6-7,10H,8-9H2,1-5H3