3-nitro-4-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C21H24N4O5S MolecularWeight: 444.50406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5S/c26-21(16-5-10-19(20(15-16)25(27)28)23-11-1-2-12-23)22-17-6-8-18(9-7-17)31(29,30)24-13-3-4-14-24/h5-10,15H,1-4,11-14H2,(H,22,26)