N-(4-iodophenyl)-2-(3-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: N-(4-iodophenyl)-2-(3-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-N-(4-iodophenyl)-2-(m-tolyl)-5-nitro-triazol-4-imine CAS Name: 3-hydroxy-N-(4-iodophenyl)-2-(3-methylphenyl)-5-nitro-4-triazolimine IUPAC Name: 3-hydroxy-N-(4-iodophenyl)-2-(3-methylphenyl)-5-nitrotriazol-4-imine Traditional Name: [3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]-(4-iodophenyl)amine Formula: C15H12IN5O3 MolecularWeight: 437.19195

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2N=C(C(=NC3=CC=C(C=C3)I)N2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2N=C(C(=NC3=CC=C(C=C3)I)N2O)[N+](=O)[O-]

InChI

InChI=1S/C15H12IN5O3/c1-10-3-2-4-13(9-10)19-18-15(21(23)24)14(20(19)22)17-12-7-5-11(16)6-8-12/h2-9,22H,1H3