3-[2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]propanoate

Systemtic Name: 3-[2-azanyl-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]propanoate Openeye Name: 3-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-5-yl]propanoate CAS Name: 3-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-thiazolyl]propanoate IUPAC Name: 3-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-5-yl]propanoate Traditional Name: 3-[2-amino-4-(2,3-dihydro-1,4-benzodioxin-6-yl)thiazol-5-yl]propionate Formula: C14H13N2O4S- MolecularWeight: 305.32902

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C3=C(SC(=N3)N)CCC(=O)[O-]

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C3=C(SC(=N3)N)CCC(=O)[O-]

InChI

InChI=1S/C14H14N2O4S/c15-14-16-13(11(21-14)3-4-12(17)18)8-1-2-9-10(7-8)20-6-5-19-9/h1-2,7H,3-6H2,(H2,15,16)(H,17,18)/p-1