5-nitro-3-oxidanyl-2-phenyl-N-[(2R)-4-phenylbutan-2-yl]-1,2,3-triazol-4-imine

Systemtic Name: 5-nitro-3-oxidanyl-2-phenyl-N-[(2R)-4-phenylbutan-2-yl]-1,2,3-triazol-4-imine Openeye Name: 3-hydroxy-N-[(1R)-1-methyl-3-phenyl-propyl]-5-nitro-2-phenyl-triazol-4-imine CAS Name: 3-hydroxy-5-nitro-2-phenyl-N-[(2R)-4-phenylbutan-2-yl]-4-triazolimine IUPAC Name: 3-hydroxy-5-nitro-2-phenyl-N-[(2R)-4-phenylbutan-2-yl]triazol-4-imine Traditional Name: (3-hydroxy-5-nitro-2-phenyl-triazol-4-ylidene)-[(1R)-1-methyl-3-phenyl-propyl]amine Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](CCC1=CC=CC=C1)N=C2C(=NN(N2O)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O3/c1-14(12-13-15-8-4-2-5-9-15)19-17-18(23(25)26)20-21(22(17)24)16-10-6-3-7-11-16/h2-11,14,24H,12-13H2,1H3/t14-/m1/s1