methyl 6-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-[[5-(furan-2-yl)-2-phenyl-pyrazol-3-yl]carbonylamino]hexanoate Openeye Name: methyl 6-[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]hexanoate CAS Name: 6-[[[5-(2-furanyl)-2-phenyl-3-pyrazolyl]-oxomethyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[[5-(furan-2-yl)-2-phenylpyrazole-3-carbonyl]amino]hexanoate Traditional Name: 6-[[5-(2-furyl)-2-phenyl-pyrazole-3-carbonyl]amino]hexanoic acid methyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N3O4/c1-27-20(25)12-6-3-7-13-22-21(26)18-15-17(19-11-8-14-28-19)23-24(18)16-9-4-2-5-10-16/h2,4-5,8-11,14-15H,3,6-7,12-13H2,1H3,(H,22,26)