N-[(E)-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-3-nitro-benzamide

Systemtic Name: N-[(E)-[3-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-3-nitro-benzamide Openeye Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]-3-nitro-benzamide CAS Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-3-nitrobenzamide IUPAC Name: N-[(E)-[3-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-3-nitrobenzamide Traditional Name: N-[(E)-[3-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]-3-nitro-benzamide Formula: C21H20BrN5O4 MolecularWeight: 486.3186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=C(C=CC(=C2)C=NNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=C(C=CC(=C2)/C=N/NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC)C)Br

InChI

InChI=1S/C21H20BrN5O4/c1-13-20(22)14(2)26(25-13)12-17-9-15(7-8-19(17)31-3)11-23-24-21(28)16-5-4-6-18(10-16)27(29)30/h4-11H,12H2,1-3H3,(H,24,28)/b23-11+