[2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 1,3,5-trimethylpyrazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)-propan-2-yl-amino]ethyl] 1,3,5-trimethylpyrazole-4-carboxylate Openeye Name: [2-[benzyl(isopropyl)amino]-2-oxo-ethyl] 1,3,5-trimethylpyrazole-4-carboxylate CAS Name: 1,3,5-trimethyl-4-pyrazolecarboxylic acid [2-oxo-2-[(phenylmethyl)-propan-2-ylamino]ethyl] ester IUPAC Name: [2-[benzyl(propan-2-yl)amino]-2-oxoethyl] 1,3,5-trimethylpyrazole-4-carboxylate Traditional Name: 1,3,5-trimethylpyrazole-4-carboxylic acid [2-[benzyl(isopropyl)amino]-2-keto-ethyl] ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)OCC(=O)N(CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C19H25N3O3/c1-13(2)22(11-16-9-7-6-8-10-16)17(23)12-25-19(24)18-14(3)20-21(5)15(18)4/h6-10,13H,11-12H2,1-5H3