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

Systemtic Name: [2-oxidanylidene-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(2-bromanyl-4-methyl-phenoxy)ethanoate Openeye Name: [2-oxo-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] 2-(2-bromo-4-methyl-phenoxy)acetate CAS Name: 2-(2-bromo-4-methylphenoxy)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-(2-bromo-4-methylphenoxy)acetate Traditional Name: 2-(2-bromo-4-methyl-phenoxy)acetic acid [2-keto-2-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl] ester Formula: C17H20BrN3O4 MolecularWeight: 410.2624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCC(=O)OCC(=O)NC2=C(N(N=C2C)C)C)Br

Isomeric SMILES

CC1=CC(=C(C=C1)OCC(=O)OCC(=O)NC2=C(N(N=C2C)C)C)Br

InChI

InChI=1S/C17H20BrN3O4/c1-10-5-6-14(13(18)7-10)24-9-16(23)25-8-15(22)19-17-11(2)20-21(4)12(17)3/h5-7H,8-9H2,1-4H3,(H,19,22)