(1-butyl-1,2,3,4-tetrazol-5-yl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (1-butyl-1,2,3,4-tetrazol-5-yl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (1-butyltetrazol-5-yl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (1-butyl-5-tetrazolyl)methyl ester IUPAC Name: (1-butyltetrazol-5-yl)methyl (3R)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3R)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (1-butyltetrazol-5-yl)methyl ester Formula: C15H18N4O4 MolecularWeight: 318.32782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NN=N1)COC(=O)C2COC3=CC=CC=C3O2

Isomeric SMILES

CCCCN1C(=NN=N1)COC(=O)[C@H]2COC3=CC=CC=C3O2

InChI

InChI=1S/C15H18N4O4/c1-2-3-8-19-14(16-17-18-19)10-22-15(20)13-9-21-11-6-4-5-7-12(11)23-13/h4-7,13H,2-3,8-10H2,1H3/t13-/m1/s1