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

Systemtic Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methylideneamino]-3-oxidanyl-benzamide Openeye Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-phenyl]methyleneamino]-3-hydroxy-benzamide CAS Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-methoxyphenyl]methylideneamino]-3-hydroxybenzamide IUPAC Name: N-[(E)-[3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-methoxyphenyl]methylideneamino]-3-hydroxybenzamide Traditional Name: N-[(E)-[3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-methoxy-benzylidene]amino]-3-hydroxy-benzamide Formula: C21H21N5O5 MolecularWeight: 423.42194

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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)O)OC)C)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C21H21N5O5/c1-13-20(26(29)30)14(2)25(24-13)12-17-9-15(7-8-19(17)31-3)11-22-23-21(28)16-5-4-6-18(27)10-16/h4-11,27H,12H2,1-3H3,(H,23,28)/b22-11+