[2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-(pyrazol-1-ylmethyl)benzoate

Systemtic Name: [2-oxidanylidene-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-(pyrazol-1-ylmethyl)benzoate Openeye Name: [2-[[(1S)-1-methylbutyl]amino]-2-oxo-ethyl] 4-(pyrazol-1-ylmethyl)benzoate CAS Name: 4-(1-pyrazolylmethyl)benzoic acid [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(2S)-pentan-2-yl]amino]ethyl] 4-(pyrazol-1-ylmethyl)benzoate Traditional Name: 4-(pyrazol-1-ylmethyl)benzoic acid [2-keto-2-[[(1S)-1-methylbutyl]amino]ethyl] ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC=C(C=C1)CN2C=CC=N2

Isomeric SMILES

CCC[C@H](C)NC(=O)COC(=O)C1=CC=C(C=C1)CN2C=CC=N2

InChI

InChI=1S/C18H23N3O3/c1-3-5-14(2)20-17(22)13-24-18(23)16-8-6-15(7-9-16)12-21-11-4-10-19-21/h4,6-11,14H,3,5,12-13H2,1-2H3,(H,20,22)/t14-/m0/s1