2-[4-[(2-piperidin-4-yl-1,3-thiazol-5-yl)carbonylamino]phenoxy]ethanoic acid hydrate

Systemtic Name: 2-[4-[(2-piperidin-4-yl-1,3-thiazol-5-yl)carbonylamino]phenoxy]ethanoic acid hydrate Openeye Name: 2-[4-[[2-(4-piperidyl)thiazole-5-carbonyl]amino]phenoxy]acetic acid hydrate CAS Name: 2-[4-[[oxo-[2-(4-piperidinyl)-5-thiazolyl]methyl]amino]phenoxy]acetic acid hydrate IUPAC Name: 2-[4-[(2-piperidin-4-yl-1,3-thiazole-5-carbonyl)amino]phenoxy]acetic acid hydrate Traditional Name: 2-[4-[[2-(4-piperidyl)thiazole-5-carbonyl]amino]phenoxy]acetic acid hydrate Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=NC=C(S2)C(=O)NC3=CC=C(C=C3)OCC(=O)O.O

Isomeric SMILES

C1CNCCC1C2=NC=C(S2)C(=O)NC3=CC=C(C=C3)OCC(=O)O.O

InChI

InChI=1S/C17H19N3O4S.H2O/c21-15(22)10-24-13-3-1-12(2-4-13)20-16(23)14-9-19-17(25-14)11-5-7-18-8-6-11;/h1-4,9,11,18H,5-8,10H2,(H,20,23)(H,21,22);1H2