4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxo-butanoic acid CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxobutanoic acid IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-oxobutanoic acid Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-4-keto-butyric acid Formula: C12H13NO5 MolecularWeight: 251.23532

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C12H13NO5/c14-11(3-4-12(15)16)13-8-1-2-9-10(7-8)18-6-5-17-9/h1-2,7H,3-6H2,(H,13,14)(H,15,16)