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

Systemtic Name: 4-acetamido-N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]benzamide Openeye Name: 4-acetamido-N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methyleneamino]benzamide CAS Name: 4-acetamido-N-[(E)-[4-methoxy-3-[(4-nitro-1-pyrazolyl)methyl]phenyl]methylideneamino]benzamide IUPAC Name: 4-acetamido-N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]phenyl]methylideneamino]benzamide Traditional Name: 4-acetamido-N-[(E)-[4-methoxy-3-[(4-nitropyrazol-1-yl)methyl]benzylidene]amino]benzamide Formula: C21H20N6O5 MolecularWeight: 436.4207

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NN=CC2=CC(=C(C=C2)OC)CN3C=C(C=N3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)N/N=C/C2=CC(=C(C=C2)OC)CN3C=C(C=N3)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O5/c1-14(28)24-18-6-4-16(5-7-18)21(29)25-22-10-15-3-8-20(32-2)17(9-15)12-26-13-19(11-23-26)27(30)31/h3-11,13H,12H2,1-2H3,(H,24,28)(H,25,29)/b22-10+