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

Systemtic Name: 2-chloranyl-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-yl-phenyl)-5-nitro-benzamide Openeye Name: 2-chloro-N-(5-morpholinosulfonyl-2-pyrrolidin-1-yl-phenyl)-5-nitro-benzamide CAS Name: 2-chloro-N-[5-(4-morpholinylsulfonyl)-2-(1-pyrrolidinyl)phenyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-(5-morpholin-4-ylsulfonyl-2-pyrrolidin-1-ylphenyl)-5-nitrobenzamide Traditional Name: 2-chloro-N-(5-morpholinosulfonyl-2-pyrrolidino-phenyl)-5-nitro-benzamide Formula: C21H23ClN4O6S MolecularWeight: 494.94852

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H23ClN4O6S/c22-18-5-3-15(26(28)29)13-17(18)21(27)23-19-14-16(4-6-20(19)24-7-1-2-8-24)33(30,31)25-9-11-32-12-10-25/h3-6,13-14H,1-2,7-12H2,(H,23,27)