6-[4-(3-chlorophenyl)piperazin-1-yl]-1,4-dimethyl-7-nitro-quinoxaline-2,3-dione

Systemtic Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-1,4-dimethyl-7-nitro-quinoxaline-2,3-dione Openeye Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-1,4-dimethyl-7-nitro-quinoxaline-2,3-dione CAS Name: 6-[4-(3-chlorophenyl)-1-piperazinyl]-1,4-dimethyl-7-nitroquinoxaline-2,3-dione IUPAC Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]-1,4-dimethyl-7-nitroquinoxaline-2,3-dione Traditional Name: 6-[4-(3-chlorophenyl)piperazino]-1,4-dimethyl-7-nitro-quinoxaline-2,3-quinone Formula: C20H20ClN5O4 MolecularWeight: 429.8569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)[N+](=O)[O-])N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CN1C2=CC(=C(C=C2N(C(=O)C1=O)C)[N+](=O)[O-])N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C20H20ClN5O4/c1-22-15-11-17(18(26(29)30)12-16(15)23(2)20(28)19(22)27)25-8-6-24(7-9-25)14-5-3-4-13(21)10-14/h3-5,10-12H,6-9H2,1-2H3