1,3-benzodioxol-5-ylmethyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 3-(4-butyl-3-oxidanylidene-quinoxalin-2-yl)propanoate Openeye Name: 1,3-benzodioxol-5-ylmethyl 3-(4-butyl-3-oxo-quinoxalin-2-yl)propanoate CAS Name: 3-(4-butyl-3-oxo-2-quinoxalinyl)propanoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 3-(4-butyl-3-oxoquinoxalin-2-yl)propanoate Traditional Name: 3-(4-butyl-3-keto-quinoxalin-2-yl)propionic acid piperonyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCN1C2=CC=CC=C2N=C(C1=O)CCC(=O)OCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H24N2O5/c1-2-3-12-25-19-7-5-4-6-17(19)24-18(23(25)27)9-11-22(26)28-14-16-8-10-20-21(13-16)30-15-29-20/h4-8,10,13H,2-3,9,11-12,14-15H2,1H3