2-(3-methylphenyl)-N-[2-(3-methylphenyl)ethyl]-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: 2-(3-methylphenyl)-N-[2-(3-methylphenyl)ethyl]-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-2-(m-tolyl)-N-[2-(m-tolyl)ethyl]-5-nitro-triazol-4-imine CAS Name: 3-hydroxy-2-(3-methylphenyl)-N-[2-(3-methylphenyl)ethyl]-5-nitro-4-triazolimine IUPAC Name: 3-hydroxy-2-(3-methylphenyl)-N-[2-(3-methylphenyl)ethyl]-5-nitrotriazol-4-imine Traditional Name: [3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]-[2-(m-tolyl)ethyl]amine Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CCN=C2C(=NN(N2O)C3=CC=CC(=C3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)CCN=C2C(=NN(N2O)C3=CC=CC(=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O3/c1-13-5-3-7-15(11-13)9-10-19-17-18(23(25)26)20-21(22(17)24)16-8-4-6-14(2)12-16/h3-8,11-12,24H,9-10H2,1-2H3