N-[(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine

Systemtic Name: N-[(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Openeye Name: N-[(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine CAS Name: N-[(2-bromophenyl)-(1-methyl-4-pyrazolyl)methyl]-1-propanamine IUPAC Name: N-[(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine Traditional Name: [(2-bromophenyl)-(1-methylpyrazol-4-yl)methyl]-propyl-amine Formula: C14H18BrN3 MolecularWeight: 308.21682

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(C1=CC=CC=C1Br)C2=CN(N=C2)C

Isomeric SMILES

CCCNC(C1=CC=CC=C1Br)C2=CN(N=C2)C

InChI

InChI=1S/C14H18BrN3/c1-3-8-16-14(11-9-17-18(2)10-11)12-6-4-5-7-13(12)15/h4-7,9-10,14,16H,3,8H2,1-2H3