N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzamide

Systemtic Name: N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoyl]-2,5-dimethyl-pyrrol-1-yl]benzamide Openeye Name: N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzamide CAS Name: N-[3-[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]-2,5-dimethyl-1-pyrrolyl]benzamide IUPAC Name: N-[3-[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]-2,5-dimethylpyrrol-1-yl]benzamide Traditional Name: N-[3-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]-2,5-dimethyl-pyrrol-1-yl]benzamide Formula: C20H21N5O4 MolecularWeight: 395.41184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(N1NC(=O)C2=CC=CC=C2)C)C(=O)CN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N5O4/c1-12-10-17(14(3)24(12)22-20(27)16-8-6-5-7-9-16)18(26)11-23-15(4)19(25(28)29)13(2)21-23/h5-10H,11H2,1-4H3,(H,22,27)