2-(4-methylphenyl)-6-(4-nitrophenyl)-4-phenyl-1$l^{2},2,4,5-tetrazin-3-one

Systemtic Name: 2-(4-methylphenyl)-6-(4-nitrophenyl)-4-phenyl-1$l^{2},2,4,5-tetrazin-3-one Openeye Name: 6-(4-nitrophenyl)-2-phenyl-4-(p-tolyl)-1,2,4,5$l^{2}-tetrazin-3-one CAS Name: 2-(4-methylphenyl)-6-(4-nitrophenyl)-4-phenyl-1$l^{2},2,4,5-tetrazin-3-one IUPAC Name: 2-(4-methylphenyl)-6-(4-nitrophenyl)-4-phenyl-1$l^{2},2,4,5-tetrazin-3-one Traditional Name: 6-(4-nitrophenyl)-2-phenyl-4-(p-tolyl)-1,2,4,5$l^{2}-tetrazin-3-one Formula: C21H16N5O3 MolecularWeight: 386.38344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)N(N=C([N]2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)N(N=C([N]2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C21H16N5O3/c1-15-7-11-18(12-8-15)25-21(27)24(17-5-3-2-4-6-17)22-20(23-25)16-9-13-19(14-10-16)26(28)29/h2-14H,1H3