2-[1,3-benzodioxol-5-ylmethyl(propan-2-yl)amino]ethanoic acid

Systemtic Name: 2-[1,3-benzodioxol-5-ylmethyl(propan-2-yl)amino]ethanoic acid Openeye Name: 2-[1,3-benzodioxol-5-ylmethyl(isopropyl)amino]acetic acid CAS Name: 2-[1,3-benzodioxol-5-ylmethyl(propan-2-yl)amino]acetic acid IUPAC Name: 2-[1,3-benzodioxol-5-ylmethyl(propan-2-yl)amino]acetic acid Traditional Name: 2-[isopropyl(piperonyl)amino]acetic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC2=C(C=C1)OCO2)CC(=O)O

Isomeric SMILES

CC(C)N(CC1=CC2=C(C=C1)OCO2)CC(=O)O

InChI

InChI=1S/C13H17NO4/c1-9(2)14(7-13(15)16)6-10-3-4-11-12(5-10)18-8-17-11/h3-5,9H,6-8H2,1-2H3,(H,15,16)