N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-1-amine

Systemtic Name: N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-1-amine Openeye Name: N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-1-amine CAS Name: N-(4-methylsulfonyl-2-nitrophenyl)-1-piperidinamine IUPAC Name: N-(4-methylsulfonyl-2-nitrophenyl)piperidin-1-amine Traditional Name: (4-mesyl-2-nitro-phenyl)-piperidino-amine Formula: C12H17N3O4S MolecularWeight: 299.34608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NN2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NN2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4S/c1-20(18,19)10-5-6-11(12(9-10)15(16)17)13-14-7-3-2-4-8-14/h5-6,9,13H,2-4,7-8H2,1H3