3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: 3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl 1,3-benzodioxole-5-carboxylate Openeye Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid 3-(2-oxo-3H-benzimidazol-1-yl)propyl ester IUPAC Name: 3-(2-oxo-3H-benzimidazol-1-yl)propyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid 3-(2-keto-3H-benzimidazol-1-yl)propyl ester Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCCCN3C4=CC=CC=C4NC3=O

InChI

InChI=1S/C18H16N2O5/c21-17(12-6-7-15-16(10-12)25-11-24-15)23-9-3-8-20-14-5-2-1-4-13(14)19-18(20)22/h1-2,4-7,10H,3,8-9,11H2,(H,19,22)