6-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-6-oxidanylidene-hexanoic acid

Systemtic Name: 6-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-6-oxidanylidene-hexanoic acid Openeye Name: 6-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-6-oxo-hexanoic acid CAS Name: 6-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-6-oxohexanoic acid IUPAC Name: 6-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-6-oxohexanoic acid Traditional Name: 6-keto-6-[methyl(piperonyl)amino]hexanoic acid Formula: C15H19NO5 MolecularWeight: 293.31506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO5/c1-16(14(17)4-2-3-5-15(18)19)9-11-6-7-12-13(8-11)21-10-20-12/h6-8H,2-5,9-10H2,1H3,(H,18,19)