4-(5-chloranylthiophen-2-yl)-2-(cyclohexylmethyl)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(5-chloranylthiophen-2-yl)-2-(cyclohexylmethyl)-4-oxidanylidene-butanoic acid Openeye Name: 4-(5-chloro-2-thienyl)-2-(cyclohexylmethyl)-4-oxo-butanoic acid CAS Name: 4-(5-chloro-2-thiophenyl)-2-(cyclohexylmethyl)-4-oxobutanoic acid IUPAC Name: 4-(5-chlorothiophen-2-yl)-2-(cyclohexylmethyl)-4-oxobutanoic acid Traditional Name: 4-(5-chloro-2-thienyl)-2-(cyclohexylmethyl)-4-keto-butyric acid Formula: C15H19ClO3S MolecularWeight: 314.82756

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(CC(=O)C2=CC=C(S2)Cl)C(=O)O

Isomeric SMILES

C1CCC(CC1)CC(CC(=O)C2=CC=C(S2)Cl)C(=O)O

InChI

InChI=1S/C15H19ClO3S/c16-14-7-6-13(20-14)12(17)9-11(15(18)19)8-10-4-2-1-3-5-10/h6-7,10-11H,1-5,8-9H2,(H,18,19)