N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-nitropyrazol-1-yl)ethanamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-nitropyrazol-1-yl)ethanamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(4-nitropyrazol-1-yl)acetamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2-(4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2-(4-nitropyrazol-1-yl)acetamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2-(4-nitropyrazol-1-yl)acetamide Formula: C15H16ClN5O5S MolecularWeight: 413.83604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NC(=O)CN3C=C(C=N3)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H16ClN5O5S/c16-13-4-3-11(7-14(13)27(25,26)20-5-1-2-6-20)18-15(22)10-19-9-12(8-17-19)21(23)24/h3-4,7-9H,1-2,5-6,10H2,(H,18,22)