1,3-benzodioxol-5-ylmethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: 1,3-benzodioxol-5-ylmethyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: 1,3-benzodioxol-5-ylmethyl-[2-(isopropylamino)-2-oxo-ethyl]ammonium CAS Name: 1,3-benzodioxol-5-ylmethyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: 1,3-benzodioxol-5-ylmethyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-(isopropylamino)-2-keto-ethyl]-piperonyl-ammonium Formula: C13H19N2O3+ MolecularWeight: 251.30156

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH2+]CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)NC(=O)C[NH2+]CC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C13H18N2O3/c1-9(2)15-13(16)7-14-6-10-3-4-11-12(5-10)18-8-17-11/h3-5,9,14H,6-8H2,1-2H3,(H,15,16)/p+1