N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-(2,6-dimethyl-4-nitro-phenoxy)ethanamide

Systemtic Name: N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-2-(2,6-dimethyl-4-nitro-phenoxy)ethanamide Openeye Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(2,6-dimethyl-4-nitro-phenoxy)acetamide CAS Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-2-(2,6-dimethyl-4-nitrophenoxy)acetamide IUPAC Name: N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-2-(2,6-dimethyl-4-nitrophenoxy)acetamide Traditional Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-2-(2,6-dimethyl-4-nitro-phenoxy)acetamide Formula: C21H20ClN5O4 MolecularWeight: 441.8676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)NN=CC2=C(N(N=C2C)C3=CC=CC=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N/N=C/C2=C(N(N=C2C)C3=CC=CC=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C21H20ClN5O4/c1-13-9-17(27(29)30)10-14(2)20(13)31-12-19(28)24-23-11-18-15(3)25-26(21(18)22)16-7-5-4-6-8-16/h4-11H,12H2,1-3H3,(H,24,28)/b23-11+