N-(2,2-dimethyloxan-4-yl)-2-methyl-5-nitro-N-(1-phenylethyl)-1,2,4-triazol-3-amine

Systemtic Name: N-(2,2-dimethyloxan-4-yl)-2-methyl-5-nitro-N-(1-phenylethyl)-1,2,4-triazol-3-amine Openeye Name: N-(2,2-dimethyltetrahydropyran-4-yl)-2-methyl-5-nitro-N-(1-phenylethyl)-1,2,4-triazol-3-amine CAS Name: N-(2,2-dimethyl-4-oxanyl)-2-methyl-5-nitro-N-(1-phenylethyl)-1,2,4-triazol-3-amine IUPAC Name: N-(2,2-dimethyloxan-4-yl)-2-methyl-5-nitro-N-(1-phenylethyl)-1,2,4-triazol-3-amine Traditional Name: (2,2-dimethyltetrahydropyran-4-yl)-(2-methyl-5-nitro-1,2,4-triazol-3-yl)-(1-phenylethyl)amine Formula: C18H25N5O3 MolecularWeight: 359.4228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(C2CCOC(C2)(C)C)C3=NC(=NN3C)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1)N(C2CCOC(C2)(C)C)C3=NC(=NN3C)[N+](=O)[O-]

InChI

InChI=1S/C18H25N5O3/c1-13(14-8-6-5-7-9-14)22(15-10-11-26-18(2,3)12-15)17-19-16(23(24)25)20-21(17)4/h5-9,13,15H,10-12H2,1-4H3