(phenylmethyl) 2-[[1-methoxy-1-oxidanylidene-3-(1H-pyrazol-5-yl)propan-2-yl]amino]-4-methyl-pentanoate

Systemtic Name: (phenylmethyl) 2-[[1-methoxy-1-oxidanylidene-3-(1H-pyrazol-5-yl)propan-2-yl]amino]-4-methyl-pentanoate Openeye Name: benzyl 2-[[2-methoxy-2-oxo-1-(1H-pyrazol-5-ylmethyl)ethyl]amino]-4-methyl-pentanoate CAS Name: 2-[[1-methoxy-1-oxo-3-(1H-pyrazol-5-yl)propan-2-yl]amino]-4-methylpentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[1-methoxy-1-oxo-3-(1H-pyrazol-5-yl)propan-2-yl]amino]-4-methylpentanoate Traditional Name: 2-[[2-keto-2-methoxy-1-(1H-pyrazol-5-ylmethyl)ethyl]amino]-4-methyl-valeric acid benzyl ester Formula: C20H27N3O4 MolecularWeight: 373.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CC2=CC=NN2)C(=O)OC

Isomeric SMILES

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CC2=CC=NN2)C(=O)OC

InChI

InChI=1S/C20H27N3O4/c1-14(2)11-17(20(25)27-13-15-7-5-4-6-8-15)22-18(19(24)26-3)12-16-9-10-21-23-16/h4-10,14,17-18,22H,11-13H2,1-3H3,(H,21,23)