N-[3-[(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)amino]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[3-[(4-nitro-2-pyrrolidin-1-ylsulfonyl-phenyl)amino]phenyl]cyclopropanecarboxamide Openeye Name: N-[3-(4-nitro-2-pyrrolidin-1-ylsulfonyl-anilino)phenyl]cyclopropanecarboxamide CAS Name: N-[3-[4-nitro-2-(1-pyrrolidinylsulfonyl)anilino]phenyl]cyclopropanecarboxamide IUPAC Name: N-[3-(4-nitro-2-pyrrolidin-1-ylsulfonylanilino)phenyl]cyclopropanecarboxamide Traditional Name: N-[3-(4-nitro-2-pyrrolidinosulfonyl-anilino)phenyl]cyclopropanecarboxamide Formula: C20H22N4O5S MolecularWeight: 430.47748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3=CC(=CC=C3)NC(=O)C4CC4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])NC3=CC(=CC=C3)NC(=O)C4CC4

InChI

InChI=1S/C20H22N4O5S/c25-20(14-6-7-14)22-16-5-3-4-15(12-16)21-18-9-8-17(24(26)27)13-19(18)30(28,29)23-10-1-2-11-23/h3-5,8-9,12-14,21H,1-2,6-7,10-11H2,(H,22,25)