1-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]phenyl]-2-pyrrolidone Formula: C17H18N4O4 MolecularWeight: 342.34922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)C2=CC=C(C=C2)N3CCCC3=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)C2=CC=C(C=C2)N3CCCC3=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H18N4O4/c1-11-17(21(24)25)12(2)20(18-11)10-15(22)13-5-7-14(8-6-13)19-9-3-4-16(19)23/h5-8H,3-4,9-10H2,1-2H3