propan-2-yl 4-[[5-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzoate

Systemtic Name: propan-2-yl 4-[[5-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-yl]carbonylamino]benzoate Openeye Name: isopropyl 4-[[5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzoate CAS Name: 4-[[[5-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-2-furanyl]-oxomethyl]amino]benzoic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-[[5-[(4-chloro-3,5-dimethylpyrazol-1-yl)methyl]furan-2-carbonyl]amino]benzoate Traditional Name: 4-[[5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-2-furoyl]amino]benzoic acid isopropyl ester Formula: C21H22ClN3O4 MolecularWeight: 415.87008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)C(=O)OC(C)C)C)Cl

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3=CC=C(C=C3)C(=O)OC(C)C)C)Cl

InChI

InChI=1S/C21H22ClN3O4/c1-12(2)28-21(27)15-5-7-16(8-6-15)23-20(26)18-10-9-17(29-18)11-25-14(4)19(22)13(3)24-25/h5-10,12H,11H2,1-4H3,(H,23,26)