(E)-4-oxidanylidene-4-(3-phenyl-3-thiophen-2-yl-propoxy)but-2-enoic acid

Systemtic Name: (E)-4-oxidanylidene-4-(3-phenyl-3-thiophen-2-yl-propoxy)but-2-enoic acid Openeye Name: (E)-4-oxo-4-[3-phenyl-3-(2-thienyl)propoxy]but-2-enoic acid CAS Name: (E)-4-oxo-4-(3-phenyl-3-thiophen-2-ylpropoxy)-2-butenoic acid IUPAC Name: (E)-4-oxo-4-(3-phenyl-3-thiophen-2-ylpropoxy)but-2-enoic acid Traditional Name: (E)-4-keto-4-[3-phenyl-3-(2-thienyl)propoxy]but-2-enoic acid Formula: C17H16O4S MolecularWeight: 316.37154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCOC(=O)C=CC(=O)O)C2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)C(CCOC(=O)/C=C/C(=O)O)C2=CC=CS2

InChI

InChI=1S/C17H16O4S/c18-16(19)8-9-17(20)21-11-10-14(15-7-4-12-22-15)13-5-2-1-3-6-13/h1-9,12,14H,10-11H2,(H,18,19)/b9-8+