2-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]-4-bromanyl-6-iodanyl-phenolate

Systemtic Name: 2-[(E)-[2,4-bis(oxidanylidene)-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene]methyl]-4-bromanyl-6-iodanyl-phenolate Openeye Name: 4-bromo-2-[(E)-(2,4-dioxo-3-prop-2-ynyl-thiazolidin-5-ylidene)methyl]-6-iodo-phenolate CAS Name: 4-bromo-2-[(E)-(2,4-dioxo-3-prop-2-ynyl-5-thiazolidinylidene)methyl]-6-iodophenolate IUPAC Name: 4-bromo-2-[(E)-(2,4-dioxo-3-prop-2-ynyl-1,3-thiazolidin-5-ylidene)methyl]-6-iodophenolate Traditional Name: 4-bromo-2-[(E)-(2,4-diketo-3-propargyl-thiazolidin-5-ylidene)methyl]-6-iodo-phenolate Formula: C13H6BrINO3S- MolecularWeight: 463.06511

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN1C(=O)C(=CC2=CC(=CC(=C2[O-])I)Br)SC1=O

Isomeric SMILES

C#CCN1C(=O)/C(=C\C2=CC(=CC(=C2[O-])I)Br)/SC1=O

InChI

InChI=1S/C13H7BrINO3S/c1-2-3-16-12(18)10(20-13(16)19)5-7-4-8(14)6-9(15)11(7)17/h1,4-6,17H,3H2/p-1/b10-5+