N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-iodanyl-aniline

Systemtic Name: N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-iodanyl-aniline Openeye Name: N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-iodo-aniline CAS Name: N-[(3,5-dimethyl-1-pyrazolyl)methyl]-4-iodoaniline IUPAC Name: N-[(3,5-dimethylpyrazol-1-yl)methyl]-4-iodoaniline Traditional Name: (3,5-dimethylpyrazol-1-yl)methyl-(4-iodophenyl)amine Formula: C12H14IN3 MolecularWeight: 327.16413

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CNC2=CC=C(C=C2)I)C

Isomeric SMILES

CC1=CC(=NN1CNC2=CC=C(C=C2)I)C

InChI

InChI=1S/C12H14IN3/c1-9-7-10(2)16(15-9)8-14-12-5-3-11(13)4-6-12/h3-7,14H,8H2,1-2H3