N-[(4-bromanyl-2-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]ethanamine

Systemtic Name: N-[(4-bromanyl-2-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]ethanamine Openeye Name: N-[(4-bromo-2-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]ethanamine CAS Name: N-[(4-bromo-2-methylphenyl)-(1-methyl-4-pyrazolyl)methyl]ethanamine IUPAC Name: N-[(4-bromo-2-methylphenyl)-(1-methylpyrazol-4-yl)methyl]ethanamine Traditional Name: [(4-bromo-2-methyl-phenyl)-(1-methylpyrazol-4-yl)methyl]-ethyl-amine Formula: C14H18BrN3 MolecularWeight: 308.21682

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(C1=C(C=C(C=C1)Br)C)C2=CN(N=C2)C

Isomeric SMILES

CCNC(C1=C(C=C(C=C1)Br)C)C2=CN(N=C2)C

InChI

InChI=1S/C14H18BrN3/c1-4-16-14(11-8-17-18(3)9-11)13-6-5-12(15)7-10(13)2/h5-9,14,16H,4H2,1-3H3