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

Systemtic Name: 4-[[2-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)hydrazinyl]methylidene]-2-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(4,6-dimorpholino-1,3,5-triazin-2-yl)hydrazino]methylene]-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[[[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]hydrazo]methylidene]-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)hydrazinyl]methylidene]-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-(4,6-dimorpholino-s-triazin-2-yl)hydrazino]methylene]-2-nitro-cyclohexa-2,5-dien-1-one Formula: C18H22N8O5 MolecularWeight: 430.41788

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC(=N2)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

C1COCCN1C2=NC(=NC(=N2)NNC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C18H22N8O5/c27-15-2-1-13(11-14(15)26(28)29)12-19-23-16-20-17(24-3-7-30-8-4-24)22-18(21-16)25-5-9-31-10-6-25/h1-2,11-12,19H,3-10H2,(H,20,21,22,23)