2-[4-(4-ethoxycarbonylpiperidin-1-yl)carbothioyl-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(4-ethoxycarbonylpiperidin-1-yl)carbothioyl-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-(4-ethoxycarbonylpiperidine-1-carbothioyl)-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(4-ethoxycarbonyl-1-piperidinyl)-sulfanylidenemethyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-(4-ethoxycarbonylpiperidine-1-carbothioyl)-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-(4-carbethoxypiperidine-1-carbothioyl)-2-methoxy-phenoxy]acetic acid Formula: C18H23NO6S MolecularWeight: 381.44332

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO6S/c1-3-24-18(22)12-6-8-19(9-7-12)17(26)13-4-5-14(15(10-13)23-2)25-11-16(20)21/h4-5,10,12H,3,6-9,11H2,1-2H3,(H,20,21)