N-(1,3-benzodioxol-5-ylmethyl)-3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonyl-propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[1,4-dimethyl-2,3-bis(oxidanylidene)quinoxalin-6-yl]sulfonyl-propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1,4-dimethyl-2,3-dioxo-quinoxalin-6-yl)sulfonyl-propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(1,4-dimethyl-2,3-dioxo-6-quinoxalinyl)sulfonyl]propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(1,4-dimethyl-2,3-dioxoquinoxalin-6-yl)sulfonylpropanamide Traditional Name: 3-(2,3-diketo-1,4-dimethyl-quinoxalin-6-yl)sulfonyl-N-piperonyl-propionamide Formula: C21H21N3O7S MolecularWeight: 459.47234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4)N(C(=O)C1=O)C

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)CCC(=O)NCC3=CC4=C(C=C3)OCO4)N(C(=O)C1=O)C

InChI

InChI=1S/C21H21N3O7S/c1-23-15-5-4-14(10-16(15)24(2)21(27)20(23)26)32(28,29)8-7-19(25)22-11-13-3-6-17-18(9-13)31-12-30-17/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,22,25)