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

Systemtic Name: N-cycloheptyl-2-(3-methylphenyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: N-cycloheptyl-3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-imine CAS Name: N-cycloheptyl-3-hydroxy-2-(3-methylphenyl)-5-nitro-4-triazolimine IUPAC Name: N-cycloheptyl-3-hydroxy-2-(3-methylphenyl)-5-nitrotriazol-4-imine Traditional Name: cycloheptyl-[3-hydroxy-2-(m-tolyl)-5-nitro-triazol-4-ylidene]amine Formula: C16H21N5O3 MolecularWeight: 331.36964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2N=C(C(=NC3CCCCCC3)N2O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2N=C(C(=NC3CCCCCC3)N2O)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O3/c1-12-7-6-10-14(11-12)19-18-16(21(23)24)15(20(19)22)17-13-8-4-2-3-5-9-13/h6-7,10-11,13,22H,2-5,8-9H2,1H3