5-(1-nitropropyl)-6-phenyl-3-pyridin-2-yl-2,5-dihydro-1,2,4-triazine

Systemtic Name: 5-(1-nitropropyl)-6-phenyl-3-pyridin-2-yl-2,5-dihydro-1,2,4-triazine Openeye Name: 5-(1-nitropropyl)-6-phenyl-3-(2-pyridyl)-2,5-dihydro-1,2,4-triazine CAS Name: 5-(1-nitropropyl)-6-phenyl-3-(2-pyridinyl)-2,5-dihydro-1,2,4-triazine IUPAC Name: 5-(1-nitropropyl)-6-phenyl-3-pyridin-2-yl-2,5-dihydro-1,2,4-triazine Traditional Name: 5-(1-nitropropyl)-6-phenyl-3-(2-pyridyl)-2,5-dihydro-1,2,4-triazine Formula: C17H17N5O2 MolecularWeight: 323.34918

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C(=NNC(=N1)C2=CC=CC=N2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(C1C(=NNC(=N1)C2=CC=CC=N2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O2/c1-2-14(22(23)24)16-15(12-8-4-3-5-9-12)20-21-17(19-16)13-10-6-7-11-18-13/h3-11,14,16H,2H2,1H3,(H,19,21)