[(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate

Systemtic Name: [(2R)-1-(methoxycarbonylamino)-1-oxidanylidene-propan-2-yl] 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate Openeye Name: [(1R)-2-(methoxycarbonylamino)-1-methyl-2-oxo-ethyl] 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoate CAS Name: 3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)propanoic acid [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methoxycarbonylamino)-1-oxopropan-2-yl] 3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propionic acid [(1R)-2-(carbomethoxyamino)-2-keto-1-methyl-ethyl] ester Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)O[C@H](C)C(=O)NC(=O)OC

InChI

InChI=1S/C19H23N3O5/c1-12-16(13(2)22(21-12)15-8-6-5-7-9-15)10-11-17(23)27-14(3)18(24)20-19(25)26-4/h5-9,14H,10-11H2,1-4H3,(H,20,24,25)/t14-/m1/s1