ethyl (2R,3R)-2-benzamido-3-(3,5-dimethylpyrazol-1-yl)-3-phenyl-propanoate

Systemtic Name: ethyl (2R,3R)-2-benzamido-3-(3,5-dimethylpyrazol-1-yl)-3-phenyl-propanoate Openeye Name: ethyl (2R,3R)-2-benzamido-3-(3,5-dimethylpyrazol-1-yl)-3-phenyl-propanoate CAS Name: (2R,3R)-2-benzamido-3-(3,5-dimethyl-1-pyrazolyl)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-2-benzamido-3-(3,5-dimethylpyrazol-1-yl)-3-phenylpropanoate Traditional Name: (2R,3R)-2-benzamido-3-(3,5-dimethylpyrazol-1-yl)-3-phenyl-propionic acid ethyl ester Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)N2C(=CC(=N2)C)C)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC=CC=C1)N2C(=CC(=N2)C)C)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H25N3O3/c1-4-29-23(28)20(24-22(27)19-13-9-6-10-14-19)21(18-11-7-5-8-12-18)26-17(3)15-16(2)25-26/h5-15,20-21H,4H2,1-3H3,(H,24,27)/t20-,21-/m1/s1