N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-nitro-benzamide

Systemtic Name: N-[4-methyl-3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-nitro-benzamide Openeye Name: N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]-2-nitro-benzamide CAS Name: N-[4-methyl-3-(2-oxo-1-pyrrolidinyl)phenyl]-2-nitrobenzamide IUPAC Name: N-[4-methyl-3-(2-oxopyrrolidin-1-yl)phenyl]-2-nitrobenzamide Traditional Name: N-[3-(2-ketopyrrolidino)-4-methyl-phenyl]-2-nitro-benzamide Formula: C18H17N3O4 MolecularWeight: 339.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])N3CCCC3=O

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2[N+](=O)[O-])N3CCCC3=O

InChI

InChI=1S/C18H17N3O4/c1-12-8-9-13(11-16(12)20-10-4-7-17(20)22)19-18(23)14-5-2-3-6-15(14)21(24)25/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,19,23)