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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH2+]CC(=O)NC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(C)C[NH2+]CC(=O)NC1=CC2=C(C=C1)OCO2

InChI

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