N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-iodanyl-4-methyl-aniline

Systemtic Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-iodanyl-4-methyl-aniline Openeye Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-iodo-4-methyl-aniline CAS Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-iodo-4-methylaniline IUPAC Name: N-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-3-iodo-4-methylaniline Traditional Name: (3,5-dimethyl-1H-pyrazol-4-yl)methyl-(3-iodo-4-methyl-phenyl)amine Formula: C13H16IN3 MolecularWeight: 341.19071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=C(NN=C2C)C)I

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=C(NN=C2C)C)I

InChI

InChI=1S/C13H16IN3/c1-8-4-5-11(6-13(8)14)15-7-12-9(2)16-17-10(12)3/h4-6,15H,7H2,1-3H3,(H,16,17)