N-[[1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylpiperidin-2-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-(3-nitro-4-pyrrolidin-1-yl-phenyl)carbonylpiperidin-2-yl]methyl]methanesulfonamide Openeye Name: N-[[1-(3-nitro-4-pyrrolidin-1-yl-benzoyl)-2-piperidyl]methyl]methanesulfonamide CAS Name: N-[[1-[[3-nitro-4-(1-pyrrolidinyl)phenyl]-oxomethyl]-2-piperidinyl]methyl]methanesulfonamide IUPAC Name: N-[[1-(3-nitro-4-pyrrolidin-1-ylbenzoyl)piperidin-2-yl]methyl]methanesulfonamide Traditional Name: N-[[1-(3-nitro-4-pyrrolidino-benzoyl)-2-piperidyl]methyl]methanesulfonamide Formula: C18H26N4O5S MolecularWeight: 410.48784

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCC1CCCCN1C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)NCC1CCCCN1C(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O5S/c1-28(26,27)19-13-15-6-2-3-11-21(15)18(23)14-7-8-16(17(12-14)22(24)25)20-9-4-5-10-20/h7-8,12,15,19H,2-6,9-11,13H2,1H3