[2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoate

Systemtic Name: [2-[1-(furan-2-yl)ethylamino]-2-oxidanylidene-ethyl] 4-oxidanylidene-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoate Openeye Name: [2-[1-(2-furyl)ethylamino]-2-oxo-ethyl] 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoate CAS Name: 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoic acid [2-[1-(2-furanyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[1-(furan-2-yl)ethylamino]-2-oxoethyl] 4-oxo-4-(5-phenyl-3,4-dihydropyrazol-2-yl)butanoate Traditional Name: 4-keto-4-(3-phenyl-2-pyrazolin-1-yl)butyric acid [2-[1-(2-furyl)ethylamino]-2-keto-ethyl] ester Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NC(=O)COC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C1=CC=CO1)NC(=O)COC(=O)CCC(=O)N2CCC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C21H23N3O5/c1-15(18-8-5-13-28-18)22-19(25)14-29-21(27)10-9-20(26)24-12-11-17(23-24)16-6-3-2-4-7-16/h2-8,13,15H,9-12,14H2,1H3,(H,22,25)