(1S)-1-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-ethanamine

Systemtic Name: (1S)-1-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-ethanamine Openeye Name: (1S)-1-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-ethanamine CAS Name: (1S)-1-(3,4-dimethoxyphenyl)-2-(1-pyrazolyl)ethanamine IUPAC Name: (1S)-1-(3,4-dimethoxyphenyl)-2-pyrazol-1-ylethanamine Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)-2-pyrazol-1-yl-ethyl]amine Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CN2C=CC=N2)N)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@@H](CN2C=CC=N2)N)OC

InChI

InChI=1S/C13H17N3O2/c1-17-12-5-4-10(8-13(12)18-2)11(14)9-16-7-3-6-15-16/h3-8,11H,9,14H2,1-2H3/t11-/m1/s1