methyl 2-[(4Z)-4-(furan-2-ylmethylidene)-3,5-bis(oxidanylidene)pyrazolidin-1-yl]-5-iodanyl-benzoate

Systemtic Name: methyl 2-[(4Z)-4-(furan-2-ylmethylidene)-3,5-bis(oxidanylidene)pyrazolidin-1-yl]-5-iodanyl-benzoate Openeye Name: methyl 2-[(4Z)-4-(2-furylmethylene)-3,5-dioxo-pyrazolidin-1-yl]-5-iodo-benzoate CAS Name: 2-[(4Z)-4-(2-furanylmethylidene)-3,5-dioxo-1-pyrazolidinyl]-5-iodobenzoic acid methyl ester IUPAC Name: methyl 2-[(4Z)-4-(furan-2-ylmethylidene)-3,5-dioxopyrazolidin-1-yl]-5-iodobenzoate Traditional Name: 2-[(4Z)-4-(2-furfurylidene)-3,5-diketo-pyrazolidin-1-yl]-5-iodo-benzoic acid methyl ester Formula: C16H11IN2O5 MolecularWeight: 438.17341

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)I)N2C(=O)C(=CC3=CC=CO3)C(=O)N2

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)I)N2C(=O)/C(=C\C3=CC=CO3)/C(=O)N2

InChI

InChI=1S/C16H11IN2O5/c1-23-16(22)11-7-9(17)4-5-13(11)19-15(21)12(14(20)18-19)8-10-3-2-6-24-10/h2-8H,1H3,(H,18,20)/b12-8-