methyl 2-[[5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate

Systemtic Name: methyl 2-[[5-[(4-bromanyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]ethanoate Openeye Name: methyl 2-[[5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbonyl]amino]acetate CAS Name: 2-[[[5-[(4-bromo-3,5-dimethyl-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[5-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carbonyl]amino]acetate Traditional Name: 2-[[5-[(4-bromo-3,5-dimethyl-pyrazol-1-yl)methyl]-2-furoyl]amino]acetic acid methyl ester Formula: C14H16BrN3O4 MolecularWeight: 370.19854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NCC(=O)OC)C)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NCC(=O)OC)C)Br

InChI

InChI=1S/C14H16BrN3O4/c1-8-13(15)9(2)18(17-8)7-10-4-5-11(22-10)14(20)16-6-12(19)21-3/h4-5H,6-7H2,1-3H3,(H,16,20)