(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3,4,5-trimethoxyphenyl)ethanamine

Systemtic Name: (2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3,4,5-trimethoxyphenyl)ethanamine Openeye Name: (2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3,4,5-trimethoxyphenyl)ethanamine CAS Name: (2S)-2-(1,3-dimethyl-4-pyrazolyl)-2-(3,4,5-trimethoxyphenyl)ethanamine IUPAC Name: (2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3,4,5-trimethoxyphenyl)ethanamine Traditional Name: [(2S)-2-(1,3-dimethylpyrazol-4-yl)-2-(3,4,5-trimethoxyphenyl)ethyl]amine Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(CN)C2=CC(=C(C(=C2)OC)OC)OC)C

Isomeric SMILES

CC1=NN(C=C1[C@@H](CN)C2=CC(=C(C(=C2)OC)OC)OC)C

InChI

InChI=1S/C16H23N3O3/c1-10-13(9-19(2)18-10)12(8-17)11-6-14(20-3)16(22-5)15(7-11)21-4/h6-7,9,12H,8,17H2,1-5H3/t12-/m0/s1