3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one

Systemtic Name: 3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one Openeye Name: 3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one CAS Name: 3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one IUPAC Name: 3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one Traditional Name: 3-methyl-1-(4-nitrophenyl)-8-phenyl-4H-pyrimido[1,2-b][1,2,4,5]tetrazin-6-one Formula: C18H14N6O3 MolecularWeight: 362.34216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC(=CC(=O)N2N1)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C2=NC(=CC(=O)N2N1)C3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H14N6O3/c1-12-20-22(14-7-9-15(10-8-14)24(26)27)18-19-16(11-17(25)23(18)21-12)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,21)