6-methyl-N-[(1-phenylpyrazol-4-yl)methyl]heptan-2-amine

Systemtic Name: 6-methyl-N-[(1-phenylpyrazol-4-yl)methyl]heptan-2-amine Openeye Name: 6-methyl-N-[(1-phenylpyrazol-4-yl)methyl]heptan-2-amine CAS Name: 6-methyl-N-[(1-phenyl-4-pyrazolyl)methyl]-2-heptanamine IUPAC Name: 6-methyl-N-[(1-phenylpyrazol-4-yl)methyl]heptan-2-amine Traditional Name: 1,5-dimethylhexyl-[(1-phenylpyrazol-4-yl)methyl]amine Formula: C18H27N3 MolecularWeight: 285.42708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)NCC1=CN(N=C1)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCCC(C)NCC1=CN(N=C1)C2=CC=CC=C2

InChI

InChI=1S/C18H27N3/c1-15(2)8-7-9-16(3)19-12-17-13-20-21(14-17)18-10-5-4-6-11-18/h4-6,10-11,13-16,19H,7-9,12H2,1-3H3