N-(1,3-benzodioxol-5-ylmethyl)-3-[4-[(4-fluorophenyl)methyl]-3-oxidanylidene-quinoxalin-2-yl]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-[(4-fluorophenyl)methyl]-3-oxidanylidene-quinoxalin-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-[(4-fluorophenyl)methyl]-3-oxo-quinoxalin-2-yl]propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-[(4-fluorophenyl)methyl]-3-oxo-2-quinoxalinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-[(4-fluorophenyl)methyl]-3-oxoquinoxalin-2-yl]propanamide Traditional Name: 3-[4-(4-fluorobenzyl)-3-keto-quinoxalin-2-yl]-N-piperonyl-propionamide Formula: C26H22FN3O4 MolecularWeight: 459.468983

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC3=NC4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCC3=NC4=CC=CC=C4N(C3=O)CC5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN3O4/c27-19-8-5-17(6-9-19)15-30-22-4-2-1-3-20(22)29-21(26(30)32)10-12-25(31)28-14-18-7-11-23-24(13-18)34-16-33-23/h1-9,11,13H,10,12,14-16H2,(H,28,31)