5-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 5-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 5-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-5-oxo-pentanoic acid CAS Name: 5-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-5-oxopentanoic acid IUPAC Name: 5-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-5-oxopentanoic acid Traditional Name: 5-keto-5-[methyl(piperonyl)amino]valeric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCO2)C(=O)CCCC(=O)O

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCO2)C(=O)CCCC(=O)O

InChI

InChI=1S/C14H17NO5/c1-15(13(16)3-2-4-14(17)18)8-10-5-6-11-12(7-10)20-9-19-11/h5-7H,2-4,8-9H2,1H3,(H,17,18)