methyl 7-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]heptanoate

Systemtic Name: methyl 7-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]heptanoate Openeye Name: methyl 7-[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]heptanoate CAS Name: 7-[[[5-(2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]amino]heptanoic acid methyl ester IUPAC Name: methyl 7-[[5-(furan-2-yl)-2-phenylpyrazole-3-carbonyl]amino]heptanoate Traditional Name: 7-[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]enanthic acid methyl ester Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CO3

Isomeric SMILES

COC(=O)CCCCCCNC(=O)C1=CC(=NN1C2=CC=CC=C2)C3=CC=CO3

InChI

InChI=1S/C22H25N3O4/c1-28-21(26)13-7-2-3-8-14-23-22(27)19-16-18(20-12-9-15-29-20)24-25(19)17-10-5-4-6-11-17/h4-6,9-12,15-16H,2-3,7-8,13-14H2,1H3,(H,23,27)