[4-[4-(4-acetyloxyphenyl)-1-methyl-5-oxidanylidene-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] ethanoate

Systemtic Name: [4-[4-(4-acetyloxyphenyl)-1-methyl-5-oxidanylidene-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] ethanoate Openeye Name: [4-[4-(4-acetoxyphenyl)-1-methyl-5-oxo-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] acetate CAS Name: acetic acid [4-[4-(4-acetyloxyphenyl)-1-methyl-5-oxo-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] ester IUPAC Name: [4-[4-(4-acetyloxyphenyl)-1-methyl-5-oxo-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] acetate Traditional Name: acetic acid [4-[4-(4-acetoxyphenyl)-5-keto-1-methyl-2H-pyrrolo[2,3-c]pyrazol-4-yl]phenyl] ester Formula: C22H19N3O5 MolecularWeight: 405.40336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=C(C=C1)C2(C3=CNN(C3=NC2=O)C)C4=CC=C(C=C4)OC(=O)C

Isomeric SMILES

CC(=O)OC1=CC=C(C=C1)C2(C3=CNN(C3=NC2=O)C)C4=CC=C(C=C4)OC(=O)C

InChI

InChI=1S/C22H19N3O5/c1-13(26)29-17-8-4-15(5-9-17)22(16-6-10-18(11-7-16)30-14(2)27)19-12-23-25(3)20(19)24-21(22)28/h4-12,23H,1-3H3