N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)ethanamide; ethanoic acid

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxidanylidene-2,4-dihydro-1H-quinoxalin-2-yl)ethanamide; ethanoic acid Openeye Name: acetic acid; N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide CAS Name: acetic acid; N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide IUPAC Name: acetic acid; N-(1,3-benzodioxol-5-ylmethyl)-2-(3-oxo-2,4-dihydro-1H-quinoxalin-2-yl)acetamide Traditional Name: acetic acid; 2-(3-keto-2,4-dihydro-1H-quinoxalin-2-yl)-N-piperonyl-acetamide Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)O.C1OC2=C(O1)C=C(C=C2)CNC(=O)CC3C(=O)NC4=CC=CC=C4N3

InChI

InChI=1S/C18H17N3O4.C2H4O2/c22-17(19-9-11-5-6-15-16(7-11)25-10-24-15)8-14-18(23)21-13-4-2-1-3-12(13)20-14;1-2(3)4/h1-7,14,20H,8-10H2,(H,19,22)(H,21,23);1H3,(H,3,4)