7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione

Systemtic Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonyl-4-ethyl-1H-quinoxaline-2,3-dione Openeye Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione CAS Name: 7-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-4-ethyl-1H-quinoxaline-2,3-dione IUPAC Name: 7-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-4-ethyl-1H-quinoxaline-2,3-dione Traditional Name: 4-ethyl-7-(4-piperonylpiperazine-1-carbonyl)-1H-quinoxaline-2,3-quinone Formula: C23H24N4O5 MolecularWeight: 436.46046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)NC(=O)C1=O

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5)NC(=O)C1=O

InChI

InChI=1S/C23H24N4O5/c1-2-27-18-5-4-16(12-17(18)24-21(28)23(27)30)22(29)26-9-7-25(8-10-26)13-15-3-6-19-20(11-15)32-14-31-19/h3-6,11-12H,2,7-10,13-14H2,1H3,(H,24,28)