5-(1,3-benzodioxol-5-ylamino)-3,3-dimethyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-(1,3-benzodioxol-5-ylamino)-3,3-dimethyl-5-oxidanylidene-pentanoic acid Openeye Name: 5-(1,3-benzodioxol-5-ylamino)-3,3-dimethyl-5-oxo-pentanoic acid CAS Name: 5-(1,3-benzodioxol-5-ylamino)-3,3-dimethyl-5-oxopentanoic acid IUPAC Name: 5-(1,3-benzodioxol-5-ylamino)-3,3-dimethyl-5-oxopentanoic acid Traditional Name: 5-(1,3-benzodioxol-5-ylamino)-5-keto-3,3-dimethyl-valeric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)NC1=CC2=C(C=C1)OCO2)CC(=O)O

Isomeric SMILES

CC(C)(CC(=O)NC1=CC2=C(C=C1)OCO2)CC(=O)O

InChI

InChI=1S/C14H17NO5/c1-14(2,7-13(17)18)6-12(16)15-9-3-4-10-11(5-9)20-8-19-10/h3-5H,6-8H2,1-2H3,(H,15,16)(H,17,18)