4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]-2-piperidin-1-ylsulfonyl-aniline

Systemtic Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methylideneamino]-2-piperidin-1-ylsulfonyl-aniline Openeye Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-yl-phenyl)methyleneamino]-2-(1-piperidylsulfonyl)aniline CAS Name: 4-nitro-N-[(E)-[5-nitro-2-(1-pyrrolidinyl)phenyl]methylideneamino]-2-(1-piperidinylsulfonyl)aniline IUPAC Name: 4-nitro-N-[(E)-(5-nitro-2-pyrrolidin-1-ylphenyl)methylideneamino]-2-piperidin-1-ylsulfonylaniline Traditional Name: (4-nitro-2-piperidinosulfonyl-phenyl)-[(E)-(5-nitro-2-pyrrolidino-benzylidene)amino]amine Formula: C22H26N6O6S MolecularWeight: 502.54344

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NN=CC3=C(C=CC(=C3)[N+](=O)[O-])N4CCCC4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N/N=C/C3=C(C=CC(=C3)[N+](=O)[O-])N4CCCC4

InChI

InChI=1S/C22H26N6O6S/c29-27(30)18-7-9-21(25-10-4-5-11-25)17(14-18)16-23-24-20-8-6-19(28(31)32)15-22(20)35(33,34)26-12-2-1-3-13-26/h6-9,14-16,24H,1-5,10-13H2/b23-16+