4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-4-oxo-butanoic acid CAS Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-4-oxobutanoic acid IUPAC Name: 4-[1,3-benzodioxol-5-ylmethyl(ethyl)amino]-4-oxobutanoic acid Traditional Name: 4-[ethyl(piperonyl)amino]-4-keto-butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC(=O)O

Isomeric SMILES

CCN(CC1=CC2=C(C=C1)OCO2)C(=O)CCC(=O)O

InChI

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