1,3-benzodioxol-5-yl 3-cyanobenzoate

Systemtic Name: 1,3-benzodioxol-5-yl 3-cyanobenzoate Openeye Name: 1,3-benzodioxol-5-yl 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid 1,3-benzodioxol-5-yl ester Formula: C15H9NO4 MolecularWeight: 267.23626

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C15H9NO4/c16-8-10-2-1-3-11(6-10)15(17)20-12-4-5-13-14(7-12)19-9-18-13/h1-7H,9H2