3-(dimethylamino)-4-(4-ethanoylpiperazin-1-yl)cyclobut-3-ene-1,2-dione

Systemtic Name: 3-(dimethylamino)-4-(4-ethanoylpiperazin-1-yl)cyclobut-3-ene-1,2-dione Openeye Name: 3-(4-acetylpiperazin-1-yl)-4-(dimethylamino)cyclobut-3-ene-1,2-dione CAS Name: 3-(4-acetyl-1-piperazinyl)-4-(dimethylamino)cyclobut-3-ene-1,2-dione IUPAC Name: 3-(4-acetylpiperazin-1-yl)-4-(dimethylamino)cyclobut-3-ene-1,2-dione Traditional Name: 3-(4-acetylpiperazino)-4-(dimethylamino)cyclobut-3-ene-1,2-quinone Formula: C12H17N3O3 MolecularWeight: 251.28168

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)N(C)C

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C(=O)C2=O)N(C)C

InChI

InChI=1S/C12H17N3O3/c1-8(16)14-4-6-15(7-5-14)10-9(13(2)3)11(17)12(10)18/h4-7H2,1-3H3