2-[2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-ethyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoethyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[2-keto-2-(piperonylamino)ethyl]thiazol-4-yl]acetic acid Formula: C15H14N2O5S MolecularWeight: 334.34706

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=NC(=CS3)CC(=O)O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C15H14N2O5S/c18-13(5-14-17-10(7-23-14)4-15(19)20)16-6-9-1-2-11-12(3-9)22-8-21-11/h1-3,7H,4-6,8H2,(H,16,18)(H,19,20)