N-cycloheptyl-5-nitro-3-oxidanyl-2-phenyl-1,2,3-triazol-4-imine

Systemtic Name: N-cycloheptyl-5-nitro-3-oxidanyl-2-phenyl-1,2,3-triazol-4-imine Openeye Name: N-cycloheptyl-3-hydroxy-5-nitro-2-phenyl-triazol-4-imine CAS Name: N-cycloheptyl-3-hydroxy-5-nitro-2-phenyl-4-triazolimine IUPAC Name: N-cycloheptyl-3-hydroxy-5-nitro-2-phenyltriazol-4-imine Traditional Name: cycloheptyl-(3-hydroxy-5-nitro-2-phenyl-triazol-4-ylidene)amine Formula: C15H19N5O3 MolecularWeight: 317.34306

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O3/c21-19-14(16-12-8-4-1-2-5-9-12)15(20(22)23)17-18(19)13-10-6-3-7-11-13/h3,6-7,10-12,21H,1-2,4-5,8-9H2