N-(2-cyanoethyl)-4-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: N-(2-cyanoethyl)-4-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: N-(2-cyanoethyl)-N-isopropyl-4-nitro-benzenesulfonamide CAS Name: N-(2-cyanoethyl)-4-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-(2-cyanoethyl)-4-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-(2-cyanoethyl)-N-isopropyl-4-nitro-benzenesulfonamide Formula: C12H15N3O4S MolecularWeight: 297.3302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15N3O4S/c1-10(2)14(9-3-8-13)20(18,19)12-6-4-11(5-7-12)15(16)17/h4-7,10H,3,9H2,1-2H3