2-(4-piperidin-1-ylcarbothioylphenoxy)ethanoic acid

Systemtic Name: 2-(4-piperidin-1-ylcarbothioylphenoxy)ethanoic acid Openeye Name: 2-[4-(piperidine-1-carbothioyl)phenoxy]acetic acid CAS Name: 2-[4-[1-piperidinyl(sulfanylidene)methyl]phenoxy]acetic acid IUPAC Name: 2-[4-(piperidine-1-carbothioyl)phenoxy]acetic acid Traditional Name: 2-[4-(piperidine-1-carbothioyl)phenoxy]acetic acid Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC(=O)O

Isomeric SMILES

C1CCN(CC1)C(=S)C2=CC=C(C=C2)OCC(=O)O

InChI

InChI=1S/C14H17NO3S/c16-13(17)10-18-12-6-4-11(5-7-12)14(19)15-8-2-1-3-9-15/h4-7H,1-3,8-10H2,(H,16,17)