methyl 5-[3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyloxymethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[3-[5-chloranyl-3-methyl-1-(phenylmethyl)pyrazol-4-yl]prop-2-enoyloxymethyl]furan-2-carboxylate Openeye Name: methyl 5-[3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)prop-2-enoyloxymethyl]furan-2-carboxylate CAS Name: 5-[[3-[5-chloro-3-methyl-1-(phenylmethyl)-4-pyrazolyl]-1-oxoprop-2-enoxy]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[3-(1-benzyl-5-chloro-3-methylpyrazol-4-yl)prop-2-enoyloxymethyl]furan-2-carboxylate Traditional Name: 5-[[3-(1-benzyl-5-chloro-3-methyl-pyrazol-4-yl)acryloyl]oxymethyl]furan-2-carboxylic acid methyl ester Formula: C21H19ClN2O5 MolecularWeight: 414.83896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)OCC2=CC=C(O2)C(=O)OC)Cl)CC3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C=CC(=O)OCC2=CC=C(O2)C(=O)OC)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C21H19ClN2O5/c1-14-17(20(22)24(23-14)12-15-6-4-3-5-7-15)9-11-19(25)28-13-16-8-10-18(29-16)21(26)27-2/h3-11H,12-13H2,1-2H3