[(2S)-1-(1,3-benzodioxol-5-ylcarbonyl)pyrrolidin-2-yl]methylazanium

Systemtic Name: [(2S)-1-(1,3-benzodioxol-5-ylcarbonyl)pyrrolidin-2-yl]methylazanium Openeye Name: [(2S)-1-(1,3-benzodioxole-5-carbonyl)pyrrolidin-2-yl]methylammonium CAS Name: [(2S)-1-[1,3-benzodioxol-5-yl(oxo)methyl]-2-pyrrolidinyl]methylammonium IUPAC Name: [(2S)-1-(1,3-benzodioxole-5-carbonyl)pyrrolidin-2-yl]methylazanium Traditional Name: [(2S)-1-piperonyloylpyrrolidin-2-yl]methylammonium Formula: C13H17N2O3+ MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C2=CC3=C(C=C2)OCO3)C[NH3+]

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C2=CC3=C(C=C2)OCO3)C[NH3+]

InChI

InChI=1S/C13H16N2O3/c14-7-10-2-1-5-15(10)13(16)9-3-4-11-12(6-9)18-8-17-11/h3-4,6,10H,1-2,5,7-8,14H2/p+1/t10-/m0/s1