2-(4-methoxyphenyl)-N-(2-methylcyclohexyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine

Systemtic Name: 2-(4-methoxyphenyl)-N-(2-methylcyclohexyl)-5-nitro-3-oxidanyl-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-2-(4-methoxyphenyl)-N-(2-methylcyclohexyl)-5-nitro-triazol-4-imine CAS Name: 3-hydroxy-2-(4-methoxyphenyl)-N-(2-methylcyclohexyl)-5-nitro-4-triazolimine IUPAC Name: 3-hydroxy-2-(4-methoxyphenyl)-N-(2-methylcyclohexyl)-5-nitrotriazol-4-imine Traditional Name: [3-hydroxy-2-(4-methoxyphenyl)-5-nitro-triazol-4-ylidene]-(2-methylcyclohexyl)amine Formula: C16H21N5O4 MolecularWeight: 347.36904

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N=C2C(=NN(N2O)C3=CC=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1N=C2C(=NN(N2O)C3=CC=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H21N5O4/c1-11-5-3-4-6-14(11)17-15-16(21(23)24)18-19(20(15)22)12-7-9-13(25-2)10-8-12/h7-11,14,22H,3-6H2,1-2H3