(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(6-methoxy-1-benzofuran-3-yl)ethanoate

Systemtic Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(6-methoxy-1-benzofuran-3-yl)ethanoate Openeye Name: (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl 2-(6-methoxybenzofuran-3-yl)acetate CAS Name: 2-(6-methoxy-3-benzofuranyl)acetic acid (4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methyl ester IUPAC Name: (4-cyano-5-methyl-2-phenylpyrazol-3-yl)methyl 2-(6-methoxy-1-benzofuran-3-yl)acetate Traditional Name: 2-(6-methoxybenzofuran-3-yl)acetic acid (4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methyl ester Formula: C23H19N3O4 MolecularWeight: 401.41466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)COC(=O)CC2=COC3=C2C=CC(=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C#N)COC(=O)CC2=COC3=C2C=CC(=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H19N3O4/c1-15-20(12-24)21(26(25-15)17-6-4-3-5-7-17)14-30-23(27)10-16-13-29-22-11-18(28-2)8-9-19(16)22/h3-9,11,13H,10,14H2,1-2H3