7-methyl-3-(4-nitrophenyl)-4-oxidanylidene-6-phenyl-pyrrolo[2,1-d][1,2,3,5]tetrazine-8-carbonitrile

Systemtic Name: 7-methyl-3-(4-nitrophenyl)-4-oxidanylidene-6-phenyl-pyrrolo[2,1-d][1,2,3,5]tetrazine-8-carbonitrile Openeye Name: 7-methyl-3-(4-nitrophenyl)-4-oxo-6-phenyl-pyrrolo[2,1-d][1,2,3,5]tetrazine-8-carbonitrile CAS Name: 7-methyl-3-(4-nitrophenyl)-4-oxo-6-phenyl-8-pyrrolo[2,1-d][1,2,3,5]tetrazinecarbonitrile IUPAC Name: 7-methyl-3-(4-nitrophenyl)-4-oxo-6-phenylpyrrolo[2,1-d][1,2,3,5]tetrazine-8-carbonitrile Traditional Name: 4-keto-7-methyl-3-(4-nitrophenyl)-6-phenyl-pyrrolo[2,1-d][1,2,3,5]tetrazine-8-carbonitrile Formula: C19H12N6O3 MolecularWeight: 372.33698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C(=C1C#N)N=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(N2C(=C1C#N)N=NN(C2=O)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C19H12N6O3/c1-12-16(11-20)18-21-22-24(14-7-9-15(10-8-14)25(27)28)19(26)23(18)17(12)13-5-3-2-4-6-13/h2-10H,1H3