(phenylmethyl) N-[3-fluoranyl-4-(4-iodanylpyrazol-1-yl)phenyl]carbamate

Systemtic Name: (phenylmethyl) N-[3-fluoranyl-4-(4-iodanylpyrazol-1-yl)phenyl]carbamate Openeye Name: benzyl N-[3-fluoro-4-(4-iodopyrazol-1-yl)phenyl]carbamate CAS Name: N-[3-fluoro-4-(4-iodo-1-pyrazolyl)phenyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-fluoro-4-(4-iodopyrazol-1-yl)phenyl]carbamate Traditional Name: N-[3-fluoro-4-(4-iodopyrazol-1-yl)phenyl]carbamic acid benzyl ester Formula: C17H13FIN3O2 MolecularWeight: 437.206893

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC2=CC(=C(C=C2)N3C=C(C=N3)I)F

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC2=CC(=C(C=C2)N3C=C(C=N3)I)F

InChI

InChI=1S/C17H13FIN3O2/c18-15-8-14(6-7-16(15)22-10-13(19)9-20-22)21-17(23)24-11-12-4-2-1-3-5-12/h1-10H,11H2,(H,21,23)