N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-[(E)-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methylideneamino]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methylideneamino]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[(E)-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methylideneamino]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-[(E)-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyleneamino]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C21H20ClN5O6 MolecularWeight: 473.8664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC(=O)C2=CC(=C(C(=C2[N+](=O)[O-])OC)OC)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C21H20ClN5O6/c1-12-15(20(22)26(25-12)13-8-6-5-7-9-13)11-23-24-21(28)14-10-16(31-2)18(32-3)19(33-4)17(14)27(29)30/h5-11H,1-4H3,(H,24,28)/b23-11+