N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide Openeye Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-nitro-2-pyrrolidin-1-yl-benzamide CAS Name: N-[3-chloro-4-(2-oxo-1-pyrrolidinyl)phenyl]-5-nitro-2-(1-pyrrolidinyl)benzamide IUPAC Name: N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-nitro-2-pyrrolidin-1-ylbenzamide Traditional Name: N-[3-chloro-4-(2-ketopyrrolidino)phenyl]-5-nitro-2-pyrrolidino-benzamide Formula: C21H21ClN4O4 MolecularWeight: 428.86884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H21ClN4O4/c22-17-12-14(5-7-19(17)25-11-3-4-20(25)27)23-21(28)16-13-15(26(29)30)6-8-18(16)24-9-1-2-10-24/h5-8,12-13H,1-4,9-11H2,(H,23,28)