methyl (2R)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2R)-2-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2R)-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-3-hydroxy-propanoate CAS Name: (2R)-2-[[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoethyl]amino]-3-hydroxypropanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetyl]amino]-3-hydroxypropanoate Traditional Name: (2R)-2-[[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetyl]amino]-3-hydroxy-propionic acid methyl ester Formula: C17H21N3O4 MolecularWeight: 331.36634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NC(CO)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)N[C@H](CO)C(=O)OC

InChI

InChI=1S/C17H21N3O4/c1-11-14(9-16(22)18-15(10-21)17(23)24-3)12(2)20(19-11)13-7-5-4-6-8-13/h4-8,15,21H,9-10H2,1-3H3,(H,18,22)/t15-/m1/s1