N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-(3-morpholinoquinoxalin-2-yl)acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-[3-(4-morpholinyl)-2-quinoxalinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyano-2-(3-morpholin-4-ylquinoxalin-2-yl)acetamide Traditional Name: 2-cyano-2-(3-morpholinoquinoxalin-2-yl)-N-piperonyl-acetamide Formula: C23H21N5O4 MolecularWeight: 431.44394

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1COCCN1C2=NC3=CC=CC=C3N=C2C(C#N)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21N5O4/c24-12-16(23(29)25-13-15-5-6-19-20(11-15)32-14-31-19)21-22(28-7-9-30-10-8-28)27-18-4-2-1-3-17(18)26-21/h1-6,11,16H,7-10,13-14H2,(H,25,29)