5-oxidanylidene-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid

Systemtic Name: 5-oxidanylidene-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid Openeye Name: 5-oxo-5-[5-(3-phenylpropyl)-2-thienyl]pentanoic acid CAS Name: 5-oxo-5-[5-(3-phenylpropyl)-2-thiophenyl]pentanoic acid IUPAC Name: 5-oxo-5-[5-(3-phenylpropyl)thiophen-2-yl]pentanoic acid Traditional Name: 5-keto-5-[5-(3-phenylpropyl)-2-thienyl]valeric acid Formula: C18H20O3S MolecularWeight: 316.4146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC2=CC=C(S2)C(=O)CCCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC2=CC=C(S2)C(=O)CCCC(=O)O

InChI

InChI=1S/C18H20O3S/c19-16(10-5-11-18(20)21)17-13-12-15(22-17)9-4-8-14-6-2-1-3-7-14/h1-3,6-7,12-13H,4-5,8-11H2,(H,20,21)