dimethyl 1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-ethanoyl-pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5-ethanoyl-pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 5-acetyl-1-[(1,3-dioxoisoindolin-2-yl)methyl]pyrazole-3,4-dicarboxylate CAS Name: 5-acetyl-1-[(1,3-dioxo-2-isoindolyl)methyl]pyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-acetyl-1-[(1,3-dioxoisoindol-2-yl)methyl]pyrazole-3,4-dicarboxylate Traditional Name: 5-acetyl-1-(phthalimidomethyl)pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C18H15N3O7 MolecularWeight: 385.3276

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C(=NN1CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC)C(=O)OC

Isomeric SMILES

CC(=O)C1=C(C(=NN1CN2C(=O)C3=CC=CC=C3C2=O)C(=O)OC)C(=O)OC

InChI

InChI=1S/C18H15N3O7/c1-9(22)14-12(17(25)27-2)13(18(26)28-3)19-21(14)8-20-15(23)10-6-4-5-7-11(10)16(20)24/h4-7H,8H2,1-3H3