5-nitro-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)benzenecarbonitrile Openeye Name: 5-nitro-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)benzonitrile CAS Name: 5-nitro-2-[4-(1-pyrrolidinylsulfonyl)-1-piperazinyl]benzonitrile IUPAC Name: 5-nitro-2-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)benzonitrile Traditional Name: 5-nitro-2-(4-pyrrolidinosulfonylpiperazino)benzonitrile Formula: C15H19N5O4S MolecularWeight: 365.40746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C15H19N5O4S/c16-12-13-11-14(20(21)22)3-4-15(13)17-7-9-19(10-8-17)25(23,24)18-5-1-2-6-18/h3-4,11H,1-2,5-10H2