2-iodanyl-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide

Systemtic Name: 2-iodanyl-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Openeye Name: N-[(E)-[3-(4-benzyloxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-iodo-benzamide CAS Name: 2-iodo-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 2-iodo-N-[(E)-[1-phenyl-3-(4-phenylmethoxyphenyl)pyrazol-4-yl]methylideneamino]benzamide Traditional Name: N-[(E)-[3-(4-benzoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-iodo-benzamide Formula: C30H23IN4O2 MolecularWeight: 598.43369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3C=NNC(=O)C4=CC=CC=C4I)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=NN(C=C3/C=N/NC(=O)C4=CC=CC=C4I)C5=CC=CC=C5

InChI

InChI=1S/C30H23IN4O2/c31-28-14-8-7-13-27(28)30(36)33-32-19-24-20-35(25-11-5-2-6-12-25)34-29(24)23-15-17-26(18-16-23)37-21-22-9-3-1-4-10-22/h1-20H,21H2,(H,33,36)/b32-19+