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

Systemtic Name: 4-nitro-6-[[2-(4-phenylazanyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-[4-anilino-6-(1-piperidyl)-1,3,5-triazin-2-yl]hydrazino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[4-anilino-6-(1-piperidinyl)-1,3,5-triazin-2-yl]hydrazo]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(4-anilino-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazinyl]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-(4-anilino-6-piperidino-s-triazin-2-yl)hydrazino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C21H22N8O3 MolecularWeight: 434.45118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=N2)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])NC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=N2)NNC=C3C=C(C=CC3=O)[N+](=O)[O-])NC4=CC=CC=C4

InChI

InChI=1S/C21H22N8O3/c30-18-10-9-17(29(31)32)13-15(18)14-22-27-20-24-19(23-16-7-3-1-4-8-16)25-21(26-20)28-11-5-2-6-12-28/h1,3-4,7-10,13-14,22H,2,5-6,11-12H2,(H2,23,24,25,26,27)