(1,3-dimethyl-5-phenylmethoxy-pyrazol-4-yl)methanamine

Systemtic Name: (1,3-dimethyl-5-phenylmethoxy-pyrazol-4-yl)methanamine Openeye Name: (5-benzyloxy-1,3-dimethyl-pyrazol-4-yl)methanamine CAS Name: (1,3-dimethyl-5-phenylmethoxy-4-pyrazolyl)methanamine IUPAC Name: (1,3-dimethyl-5-phenylmethoxypyrazol-4-yl)methanamine Traditional Name: (5-benzoxy-1,3-dimethyl-pyrazol-4-yl)methylamine Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CN)OCC2=CC=CC=C2)C

Isomeric SMILES

CC1=NN(C(=C1CN)OCC2=CC=CC=C2)C

InChI

InChI=1S/C13H17N3O/c1-10-12(8-14)13(16(2)15-10)17-9-11-6-4-3-5-7-11/h3-7H,8-9,14H2,1-2H3