methyl (2S)-3-phenyl-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-[2-(1,3,5-trimethylpyrazol-4-yl)ethanoylamino]propanoate Openeye Name: methyl (2S)-3-phenyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoate CAS Name: (2S)-2-[[1-oxo-2-(1,3,5-trimethyl-4-pyrazolyl)ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propanoate Traditional Name: (2S)-3-phenyl-2-[[2-(1,3,5-trimethylpyrazol-4-yl)acetyl]amino]propionic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)CC(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H23N3O3/c1-12-15(13(2)21(3)20-12)11-17(22)19-16(18(23)24-4)10-14-8-6-5-7-9-14/h5-9,16H,10-11H2,1-4H3,(H,19,22)/t16-/m0/s1