4-[2-cyanopropyl(methyl)amino]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-cyanopropyl(methyl)amino]-3-nitro-benzenesulfonamide Openeye Name: 4-[2-cyanopropyl(methyl)amino]-3-nitro-benzenesulfonamide CAS Name: 4-[2-cyanopropyl(methyl)amino]-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-cyanopropyl(methyl)amino]-3-nitrobenzenesulfonamide Traditional Name: 4-[2-cyanopropyl(methyl)amino]-3-nitro-benzenesulfonamide Formula: C11H14N4O4S MolecularWeight: 298.31826

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N4O4S/c1-8(6-12)7-14(2)10-4-3-9(20(13,18)19)5-11(10)15(16)17/h3-5,8H,7H2,1-2H3,(H2,13,18,19)