3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole

Systemtic Name: 3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole Openeye Name: 3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole CAS Name: 3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole IUPAC Name: 3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole Traditional Name: 3-methyl-5-(4-nitrophenyl)-1-(1-phenylethyl)-1,2,4-triazole Formula: C17H16N4O2 MolecularWeight: 308.33454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=N1)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O2/c1-12(14-6-4-3-5-7-14)20-17(18-13(2)19-20)15-8-10-16(11-9-15)21(22)23/h3-12H,1-2H3