1,3-benzodioxol-5-ylmethyl 3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propanoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propanoate Openeye Name: 1,3-benzodioxol-5-ylmethyl 3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanoate CAS Name: 3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propanoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propanoate Traditional Name: 3-(1,3-diketobenzo[de]isoquinolin-2-yl)propionic acid piperonyl ester Formula: C23H17NO6 MolecularWeight: 403.38418

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC(=O)CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC(=O)CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

InChI

InChI=1S/C23H17NO6/c25-20(28-12-14-7-8-18-19(11-14)30-13-29-18)9-10-24-22(26)16-5-1-3-15-4-2-6-17(21(15)16)23(24)27/h1-8,11H,9-10,12-13H2