(2Z)-2-[2-iodanyl-1-(2-methyl-5-phenyl-thiophen-3-yl)ethylidene]-3-propan-2-ylidene-butanedioic acid

Systemtic Name: (2Z)-2-[2-iodanyl-1-(2-methyl-5-phenyl-thiophen-3-yl)ethylidene]-3-propan-2-ylidene-butanedioic acid Openeye Name: (2Z)-2-[2-iodo-1-(2-methyl-5-phenyl-3-thienyl)ethylidene]-3-isopropylidene-butanedioic acid CAS Name: (2Z)-2-[2-iodo-1-(2-methyl-5-phenyl-3-thiophenyl)ethylidene]-3-propan-2-ylidenebutanedioic acid IUPAC Name: (2Z)-2-[2-iodo-1-(2-methyl-5-phenylthiophen-3-yl)ethylidene]-3-propan-2-ylidenebutanedioic acid Traditional Name: (2Z)-2-[2-iodo-1-(2-methyl-5-phenyl-3-thienyl)ethylidene]-3-isopropylidene-succinic acid Formula: C20H19IO4S MolecularWeight: 482.33193

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C2=CC=CC=C2)C(=C(C(=C(C)C)C(=O)O)C(=O)O)CI

Isomeric SMILES

CC1=C(C=C(S1)C2=CC=CC=C2)/C(=C(\C(=C(C)C)C(=O)O)/C(=O)O)/CI

InChI

InChI=1S/C20H19IO4S/c1-11(2)17(19(22)23)18(20(24)25)15(10-21)14-9-16(26-12(14)3)13-7-5-4-6-8-13/h4-9H,10H2,1-3H3,(H,22,23)(H,24,25)/b18-15+