4-nitro-2-[(Z)-[(4-phenylazanyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenolate

Systemtic Name: 4-nitro-2-[(Z)-[(4-phenylazanyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]phenolate Openeye Name: 2-[(Z)-[[4-anilino-6-(1-piperidyl)-1,3,5-triazin-2-yl]hydrazono]methyl]-4-nitro-phenolate CAS Name: 2-[(Z)-[[4-anilino-6-(1-piperidinyl)-1,3,5-triazin-2-yl]hydrazinylidene]methyl]-4-nitrophenolate IUPAC Name: 2-[(Z)-[(4-anilino-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazinylidene]methyl]-4-nitrophenolate Traditional Name: 2-[(Z)-[(4-anilino-6-piperidino-s-triazin-2-yl)hydrazono]methyl]-4-nitro-phenolate Formula: C21H21N8O3- MolecularWeight: 433.44324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=N2)NN=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-])NC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=N2)N/N=C\C3=C(C=CC(=C3)[N+](=O)[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/h1,3-4,7-10,13-14,30H,2,5-6,11-12H2,(H2,23,24,25,26,27)/p-1/b22-14-