N-(4-ethylsulfonylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-ethylsulfonylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-ethylsulfonylphenyl)-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-(4-ethylsulfonylphenyl)-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-ethylsulfonylphenyl)-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-esylphenyl)-5-nitro-2-pyrrolidino-benzamide Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCCC3

InChI

InChI=1S/C19H21N3O5S/c1-2-28(26,27)16-8-5-14(6-9-16)20-19(23)17-13-15(22(24)25)7-10-18(17)21-11-3-4-12-21/h5-10,13H,2-4,11-12H2,1H3,(H,20,23)