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

Systemtic Name: methyl (2S)-2-[2-phenylethanoyl-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate Openeye Name: methyl (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate CAS Name: (2S)-2-[(1-oxo-2-phenylethyl)-(1,3,5-trimethyl-4-pyrazolyl)amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)amino]propanoate Traditional Name: (2S)-2-[(2-phenylacetyl)-(1,3,5-trimethylpyrazol-4-yl)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)N(C(C)C(=O)OC)C(=O)CC2=CC=CC=C2

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O3/c1-12-17(13(2)20(4)19-12)21(14(3)18(23)24-5)16(22)11-15-9-7-6-8-10-15/h6-10,14H,11H2,1-5H3/t14-/m0/s1