methyl 5-[[4-[(2-bromanyl-4,5-dimethoxy-phenyl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[4-[(2-bromanyl-4,5-dimethoxy-phenyl)carbonylamino]pyrazol-1-yl]methyl]furan-2-carboxylate Openeye Name: methyl 5-[[4-[(2-bromo-4,5-dimethoxy-benzoyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate CAS Name: 5-[[4-[[(2-bromo-4,5-dimethoxyphenyl)-oxomethyl]amino]-1-pyrazolyl]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[4-[(2-bromo-4,5-dimethoxybenzoyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylate Traditional Name: 5-[[4-[(2-bromo-4,5-dimethoxy-benzoyl)amino]pyrazol-1-yl]methyl]furan-2-carboxylic acid methyl ester Formula: C19H18BrN3O6 MolecularWeight: 464.26672

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C(=O)NC2=CN(N=C2)CC3=CC=C(O3)C(=O)OC)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)C(=O)NC2=CN(N=C2)CC3=CC=C(O3)C(=O)OC)Br)OC

InChI

InChI=1S/C19H18BrN3O6/c1-26-16-6-13(14(20)7-17(16)27-2)18(24)22-11-8-21-23(9-11)10-12-4-5-15(29-12)19(25)28-3/h4-9H,10H2,1-3H3,(H,22,24)