(E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-(2-methylfuran-3-yl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile CAS Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-[(2-methyl-3-furanyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-(2-methylfuran-3-carbonyl)prop-2-enenitrile Traditional Name: (E)-3-[5-(4-chlorophenyl)-1H-pyrazol-4-yl]-2-(2-methyl-3-furoyl)acrylonitrile Formula: C18H12ClN3O2 MolecularWeight: 337.75978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C(=O)C(=CC2=C(NN=C2)C3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CC1=C(C=CO1)C(=O)/C(=C/C2=C(NN=C2)C3=CC=C(C=C3)Cl)/C#N

InChI

InChI=1S/C18H12ClN3O2/c1-11-16(6-7-24-11)18(23)13(9-20)8-14-10-21-22-17(14)12-2-4-15(19)5-3-12/h2-8,10H,1H3,(H,21,22)/b13-8+