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

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3-oxidanylidene-4-(phenylmethyl)quinoxalin-2-yl]propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-benzyl-3-oxo-quinoxalin-2-yl)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[3-oxo-4-(phenylmethyl)-2-quinoxalinyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-benzyl-3-oxoquinoxalin-2-yl)propanamide Traditional Name: 3-(4-benzyl-3-keto-quinoxalin-2-yl)-N-piperonyl-propionamide Formula: C26H23N3O4 MolecularWeight: 441.47852

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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=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3O4/c30-25(27-15-19-10-12-23-24(14-19)33-17-32-23)13-11-21-26(31)29(16-18-6-2-1-3-7-18)22-9-5-4-8-20(22)28-21/h1-10,12,14H,11,13,15-17H2,(H,27,30)