4-[[4-[(Z)-[2,4-bis(oxidanylidene)-3-phenacyl-1,3-thiazolidin-5-ylidene]methyl]-5-bromanyl-2-ethoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(Z)-[2,4-bis(oxidanylidene)-3-phenacyl-1,3-thiazolidin-5-ylidene]methyl]-5-bromanyl-2-ethoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[5-bromo-4-[(Z)-(2,4-dioxo-3-phenacyl-thiazolidin-5-ylidene)methyl]-2-ethoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[5-bromo-4-[(Z)-(2,4-dioxo-3-phenacyl-5-thiazolidinylidene)methyl]-2-ethoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[5-bromo-4-[(Z)-(2,4-dioxo-3-phenacyl-1,3-thiazolidin-5-ylidene)methyl]-2-ethoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[5-bromo-4-[(Z)-(2,4-diketo-3-phenacyl-thiazolidin-5-ylidene)methyl]-2-ethoxy-phenoxy]methyl]benzoic acid Formula: C28H22BrNO7S MolecularWeight: 596.44578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C=C2C(=O)N(C(=O)S2)CC(=O)C3=CC=CC=C3)Br)OCC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CCOC1=C(C=C(C(=C1)/C=C\2/C(=O)N(C(=O)S2)CC(=O)C3=CC=CC=C3)Br)OCC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C28H22BrNO7S/c1-2-36-23-12-20(21(29)14-24(23)37-16-17-8-10-19(11-9-17)27(33)34)13-25-26(32)30(28(35)38-25)15-22(31)18-6-4-3-5-7-18/h3-14H,2,15-16H2,1H3,(H,33,34)/b25-13-