[1-oxidanylidene-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [1-oxidanylidene-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-[(2-isopropylpyrazol-3-yl)amino]-1-methyl-2-oxo-ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [1-oxo-1-[(2-propan-2-yl-3-pyrazolyl)amino]propan-2-yl] ester IUPAC Name: [1-oxo-1-[(2-propan-2-ylpyrazol-3-yl)amino]propan-2-yl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-[(2-isopropylpyrazol-3-yl)amino]-2-keto-1-methyl-ethyl] ester Formula: C17H20BrN3O4 MolecularWeight: 410.2624

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)C(C)OC(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)C(C)OC(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C17H20BrN3O4/c1-11(2)21-15(7-8-19-21)20-17(23)12(3)25-16(22)10-24-14-6-4-5-13(18)9-14/h4-9,11-12H,10H2,1-3H3,(H,20,23)