methyl 4-[4-[5-[[(2S)-2-methoxy-2-phenyl-ethanoyl]amino]pyrazol-1-yl]piperidin-1-yl]-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-[4-[5-[[(2S)-2-methoxy-2-phenyl-ethanoyl]amino]pyrazol-1-yl]piperidin-1-yl]-4-oxidanylidene-butanoate Openeye Name: methyl 4-[4-[5-[[(2S)-2-methoxy-2-phenyl-acetyl]amino]pyrazol-1-yl]-1-piperidyl]-4-oxo-butanoate CAS Name: 4-[4-[5-[[(2S)-2-methoxy-1-oxo-2-phenylethyl]amino]-1-pyrazolyl]-1-piperidinyl]-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-[4-[5-[[(2S)-2-methoxy-2-phenylacetyl]amino]pyrazol-1-yl]piperidin-1-yl]-4-oxobutanoate Traditional Name: 4-keto-4-[4-[5-[[(2S)-2-methoxy-2-phenyl-acetyl]amino]pyrazol-1-yl]piperidino]butyric acid methyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)C(=O)NC2=CC=NN2C3CCN(CC3)C(=O)CCC(=O)OC

Isomeric SMILES

CO[C@@H](C1=CC=CC=C1)C(=O)NC2=CC=NN2C3CCN(CC3)C(=O)CCC(=O)OC

InChI

InChI=1S/C22H28N4O5/c1-30-20(28)9-8-19(27)25-14-11-17(12-15-25)26-18(10-13-23-26)24-22(29)21(31-2)16-6-4-3-5-7-16/h3-7,10,13,17,21H,8-9,11-12,14-15H2,1-2H3,(H,24,29)/t21-/m0/s1