4-[2-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxidanylidene-ethoxy]benzenecarbonitrile Openeye Name: 4-[2-[(3R)-5-(4-chlorophenyl)-3-(2-furyl)-3,4-dihydropyrazol-2-yl]-2-oxo-ethoxy]benzonitrile CAS Name: 4-[2-[(3R)-5-(4-chlorophenyl)-3-(2-furanyl)-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzonitrile IUPAC Name: 4-[2-[(3R)-5-(4-chlorophenyl)-3-(furan-2-yl)-3,4-dihydropyrazol-2-yl]-2-oxoethoxy]benzonitrile Traditional Name: 4-[2-[(5R)-3-(4-chlorophenyl)-5-(2-furyl)-2-pyrazolin-1-yl]-2-keto-ethoxy]benzonitrile Formula: C22H16ClN3O3 MolecularWeight: 405.83374

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(N=C1C2=CC=C(C=C2)Cl)C(=O)COC3=CC=C(C=C3)C#N)C4=CC=CO4

Isomeric SMILES

C1[C@@H](N(N=C1C2=CC=C(C=C2)Cl)C(=O)COC3=CC=C(C=C3)C#N)C4=CC=CO4

InChI

InChI=1S/C22H16ClN3O3/c23-17-7-5-16(6-8-17)19-12-20(21-2-1-11-28-21)26(25-19)22(27)14-29-18-9-3-15(13-24)4-10-18/h1-11,20H,12,14H2/t20-/m1/s1