[3-methyl-5-(3-methylbutoxy)-1-phenyl-pyrazol-4-yl]methanamine

Systemtic Name: [3-methyl-5-(3-methylbutoxy)-1-phenyl-pyrazol-4-yl]methanamine Openeye Name: (5-isopentyloxy-3-methyl-1-phenyl-pyrazol-4-yl)methanamine CAS Name: [3-methyl-5-(3-methylbutoxy)-1-phenyl-4-pyrazolyl]methanamine IUPAC Name: [3-methyl-5-(3-methylbutoxy)-1-phenylpyrazol-4-yl]methanamine Traditional Name: (5-isoamoxy-3-methyl-1-phenyl-pyrazol-4-yl)methylamine Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN)OCCC(C)C)C2=CC=CC=C2

Isomeric SMILES

CC1=NN(C(=C1CN)OCCC(C)C)C2=CC=CC=C2

InChI

InChI=1S/C16H23N3O/c1-12(2)9-10-20-16-15(11-17)13(3)18-19(16)14-7-5-4-6-8-14/h4-8,12H,9-11,17H2,1-3H3