3,5-dinitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3,5-dinitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3,5-dinitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3,5-dinitro-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3,5-dinitro-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3,5-dinitro-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C17H16N4O7S MolecularWeight: 420.39654

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O7S/c22-17(12-9-14(20(23)24)11-15(10-12)21(25)26)18-13-3-5-16(6-4-13)29(27,28)19-7-1-2-8-19/h3-6,9-11H,1-2,7-8H2,(H,18,22)