N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-5-nitro-2-piperidin-1-yl-benzamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-5-nitro-2-piperidino-benzamide Formula: C22H25ClN4O5S MolecularWeight: 492.9757

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H25ClN4O5S/c23-19-8-6-16(14-21(19)33(31,32)26-12-4-5-13-26)24-22(28)18-15-17(27(29)30)7-9-20(18)25-10-2-1-3-11-25/h6-9,14-15H,1-5,10-13H2,(H,24,28)