7-iodanyl-3-[(E)-2-naphthalen-2-ylethenyl]-1-phenyl-cyclohepta[c]pyrazol-8-one

Systemtic Name: 7-iodanyl-3-[(E)-2-naphthalen-2-ylethenyl]-1-phenyl-cyclohepta[c]pyrazol-8-one Openeye Name: 7-iodo-3-[(E)-2-(2-naphthyl)vinyl]-1-phenyl-cyclohepta[c]pyrazol-8-one CAS Name: 7-iodo-3-[(E)-2-(2-naphthalenyl)ethenyl]-1-phenyl-8-cyclohepta[c]pyrazolone IUPAC Name: 7-iodo-3-[(E)-2-naphthalen-2-ylethenyl]-1-phenylcyclohepta[c]pyrazol-8-one Traditional Name: 7-iodo-3-[(E)-2-(2-naphthyl)vinyl]-1-phenyl-cyclohepta[c]pyrazol-8-one Formula: C26H17IN2O MolecularWeight: 500.33045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C3=C(C=CC=C(C3=O)I)C(=N2)C=CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C3=C(C=CC=C(C3=O)I)C(=N2)/C=C/C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H17IN2O/c27-23-12-6-11-22-24(16-14-18-13-15-19-7-4-5-8-20(19)17-18)28-29(25(22)26(23)30)21-9-2-1-3-10-21/h1-17H/b16-14+