6-[[2-[4-[(3-bromophenyl)amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]hydrazinyl]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-[4-[(3-bromophenyl)amino]-6-morpholin-4-yl-1,3,5-triazin-2-yl]hydrazinyl]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-[4-(3-bromoanilino)-6-morpholino-1,3,5-triazin-2-yl]hydrazino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[4-(3-bromoanilino)-6-(4-morpholinyl)-1,3,5-triazin-2-yl]hydrazo]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-[4-(3-bromoanilino)-6-morpholin-4-yl-1,3,5-triazin-2-yl]hydrazinyl]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-[4-(3-bromoanilino)-6-morpholino-s-triazin-2-yl]hydrazino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C20H19BrN8O4 MolecularWeight: 515.32006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])NC4=CC(=CC=C4)Br

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])NC4=CC(=CC=C4)Br

InChI

InChI=1S/C20H19BrN8O4/c21-14-2-1-3-15(11-14)23-18-24-19(26-20(25-18)28-6-8-33-9-7-28)27-22-12-13-10-16(29(31)32)4-5-17(13)30/h1-5,10-12,22H,6-9H2,(H2,23,24,25,26,27)