3-(3-nitrophenyl)-5-(phenylmethyl)-10H-imidazo[5,1-a]phthalazine-1,6-dione

Systemtic Name: 3-(3-nitrophenyl)-5-(phenylmethyl)-10H-imidazo[5,1-a]phthalazine-1,6-dione Openeye Name: 5-benzyl-3-(3-nitrophenyl)-10H-imidazo[5,1-a]phthalazine-1,6-dione CAS Name: 3-(3-nitrophenyl)-5-(phenylmethyl)-10H-imidazo[5,1-a]phthalazine-1,6-dione IUPAC Name: 5-benzyl-3-(3-nitrophenyl)-10H-imidazo[5,1-a]phthalazine-1,6-dione Traditional Name: 5-benzyl-3-(3-nitrophenyl)-10H-imidazo[5,1-a]phthalazine-1,6-quinone Formula: C23H16N4O4 MolecularWeight: 412.39754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C=CC=C2C1=C3C(=O)N=C(N3N(C2=O)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1C=CC=C2C1=C3C(=O)N=C(N3N(C2=O)CC4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O4/c28-22-20-18-11-4-5-12-19(18)23(29)25(14-15-7-2-1-3-8-15)26(20)21(24-22)16-9-6-10-17(13-16)27(30)31/h1-10,12-13H,11,14H2