N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-methyl-3-nitro-benzamide

Systemtic Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-methyl-3-nitro-benzamide Openeye Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methyleneamino]-4-methyl-3-nitro-benzamide CAS Name: N-[(E)-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]methylideneamino]-4-methyl-3-nitrobenzamide IUPAC Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]-4-methyl-3-nitrobenzamide Traditional Name: N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]benzylidene]amino]-4-methyl-3-nitro-benzamide Formula: C20H18N6O6 MolecularWeight: 438.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC)CN3C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N/N=C/C2=CC(=C(C=C2)OC)CN3C=C(C=N3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C20H18N6O6/c1-13-3-5-15(8-18(13)26(30)31)20(27)23-21-9-14-4-6-19(32-2)16(7-14)11-24-12-17(10-22-24)25(28)29/h3-10,12H,11H2,1-2H3,(H,23,27)/b21-9+