[4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-iodanyl-phenyl] ethanoate

Systemtic Name: [4-[[3,5-bis(oxidanylidene)-1-phenyl-pyrazolidin-4-ylidene]methyl]-2-iodanyl-phenyl] ethanoate Openeye Name: [4-[(3,5-dioxo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-iodo-phenyl] acetate CAS Name: acetic acid [4-[(3,5-dioxo-1-phenyl-4-pyrazolidinylidene)methyl]-2-iodophenyl] ester IUPAC Name: [4-[(3,5-dioxo-1-phenylpyrazolidin-4-ylidene)methyl]-2-iodophenyl] acetate Traditional Name: acetic acid [4-[(3,5-diketo-1-phenyl-pyrazolidin-4-ylidene)methyl]-2-iodo-phenyl] ester Formula: C18H13IN2O4 MolecularWeight: 448.21129

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)I

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)C=C2C(=O)NN(C2=O)C3=CC=CC=C3)I

InChI

InChI=1S/C18H13IN2O4/c1-11(22)25-16-8-7-12(10-15(16)19)9-14-17(23)20-21(18(14)24)13-5-3-2-4-6-13/h2-10H,1H3,(H,20,23)