(Z)-7-(4-methylthiophen-2-yl)-7-oxidanyl-5-oxidanylidene-hept-6-enoate

Systemtic Name: (Z)-7-(4-methylthiophen-2-yl)-7-oxidanyl-5-oxidanylidene-hept-6-enoate Openeye Name: (Z)-7-hydroxy-7-(4-methyl-2-thienyl)-5-oxo-hept-6-enoate CAS Name: (Z)-7-hydroxy-7-(4-methyl-2-thiophenyl)-5-oxo-6-heptenoate IUPAC Name: (Z)-7-hydroxy-7-(4-methylthiophen-2-yl)-5-oxohept-6-enoate Traditional Name: (Z)-7-hydroxy-5-keto-7-(4-methyl-2-thienyl)hept-6-enoate Formula: C12H13O4S- MolecularWeight: 253.29422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(=CC(=O)CCCC(=O)[O-])O

Isomeric SMILES

CC1=CSC(=C1)/C(=C/C(=O)CCCC(=O)[O-])/O

InChI

InChI=1S/C12H14O4S/c1-8-5-11(17-7-8)10(14)6-9(13)3-2-4-12(15)16/h5-7,14H,2-4H2,1H3,(H,15,16)/p-1/b10-6-