2-[2-[2-[(3-ethoxy-4-oxidanyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[2-[(3-ethoxy-4-oxidanyl-phenyl)methylamino]-2-oxidanylidene-ethyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[2-[(3-ethoxy-4-hydroxy-phenyl)methylamino]-2-oxo-ethyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[2-[(3-ethoxy-4-hydroxyphenyl)methylamino]-2-oxoethyl]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[2-[(3-ethoxy-4-hydroxyphenyl)methylamino]-2-oxoethyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[2-[(3-ethoxy-4-hydroxy-benzyl)amino]-2-keto-ethyl]thiazol-4-yl]acetic acid Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC(=O)CC2=NC(=CS2)CC(=O)O)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC(=O)CC2=NC(=CS2)CC(=O)O)O

InChI

InChI=1S/C16H18N2O5S/c1-2-23-13-5-10(3-4-12(13)19)8-17-14(20)7-15-18-11(9-24-15)6-16(21)22/h3-5,9,19H,2,6-8H2,1H3,(H,17,20)(H,21,22)