N-[(4-iodophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: N-[(4-iodophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Openeye Name: N-[(4-iodophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine CAS Name: N-[(4-iodophenyl)-(1-methyl-4-pyrazolyl)methyl]-1-propanamine IUPAC Name: N-[(4-iodophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Traditional Name: [(4-iodophenyl)-(1-methylpyrazol-4-yl)methyl]-propyl-amine Formula: C14H18IN3 MolecularWeight: 355.21729

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C1=CC=C(C=C1)I)C2=CN(N=C2)C

Isomeric SMILES

CCCNC(C1=CC=C(C=C1)I)C2=CN(N=C2)C

InChI

InChI=1S/C14H18IN3/c1-3-8-16-14(12-9-17-18(2)10-12)11-4-6-13(15)7-5-11/h4-7,9-10,14,16H,3,8H2,1-2H3