N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; propanoic acid

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; propanoic acid Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; propionic acid CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-propanamine; propanoic acid IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine; propanoic acid Traditional Name: isopropyl(piperonyl)amine; propionic acid Formula: C14H21NO4 MolecularWeight: 267.32084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)O.CC(C)NCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCC(=O)O.CC(C)NCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C11H15NO2.C3H6O2/c1-8(2)12-6-9-3-4-10-11(5-9)14-7-13-10;1-2-3(4)5/h3-5,8,12H,6-7H2,1-2H3;2H2,1H3,(H,4,5)