[2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(3-bromanylphenoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(3-bromanylphenoxy)ethanoate Openeye Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(3-bromophenoxy)acetate CAS Name: 2-(3-bromophenoxy)acetic acid [2-oxo-2-[(1,3,5-trimethyl-4-pyrazolyl)amino]ethyl] ester IUPAC Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(3-bromophenoxy)acetate Traditional Name: 2-(3-bromophenoxy)acetic acid [2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] ester Formula: C16H18BrN3O4 MolecularWeight: 396.23582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)COC(=O)COC2=CC(=CC=C2)Br

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)COC(=O)COC2=CC(=CC=C2)Br

InChI

InChI=1S/C16H18BrN3O4/c1-10-16(11(2)20(3)19-10)18-14(21)8-24-15(22)9-23-13-6-4-5-12(17)7-13/h4-7H,8-9H2,1-3H3,(H,18,21)