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

Systemtic Name: 1-methylsulfonyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidin-4-amine Openeye Name: 1-methylsulfonyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidin-4-amine CAS Name: 1-methylsulfonyl-N-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]-4-piperidinamine IUPAC Name: 1-methylsulfonyl-N-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperidin-4-amine Traditional Name: (1-mesyl-4-piperidyl)-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C16H24N4O6S2 MolecularWeight: 432.51496

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O6S2/c1-27(23,24)18-10-6-13(7-11-18)17-15-5-4-14(12-16(15)20(21)22)28(25,26)19-8-2-3-9-19/h4-5,12-13,17H,2-3,6-11H2,1H3