(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-(1,3-benzodioxol-5-ylcarbonylamino)ethanoate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate CAS Name: 2-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]acetic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-(1,3-benzodioxole-5-carbonylamino)acetate Traditional Name: 2-(piperonyloylamino)acetic acid (1-propyltetrazol-5-yl)methyl ester Formula: C15H17N5O5 MolecularWeight: 347.32598

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H17N5O5/c1-2-5-20-13(17-18-19-20)8-23-14(21)7-16-15(22)10-3-4-11-12(6-10)25-9-24-11/h3-4,6H,2,5,7-9H2,1H3,(H,16,22)