N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitro-benzamide

Systemtic Name: N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitro-benzamide Openeye Name: N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitro-benzamide CAS Name: N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitrobenzamide IUPAC Name: N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitrobenzamide Traditional Name: N-[2-(1-methyl-5,6-dihydro-2H-1,2,4-triazin-3-yl)phenyl]-4-nitro-benzamide Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN=C(N1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN1CCN=C(N1)C2=CC=CC=C2NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O3/c1-21-11-10-18-16(20-21)14-4-2-3-5-15(14)19-17(23)12-6-8-13(9-7-12)22(24)25/h2-9H,10-11H2,1H3,(H,18,20)(H,19,23)