5,6-dimethyl-1-(4-nitrophenyl)-2-(4-pentylphenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline

Systemtic Name: 5,6-dimethyl-1-(4-nitrophenyl)-2-(4-pentylphenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline Openeye Name: 5,6-dimethyl-1-(4-nitrophenyl)-2-(4-pentylphenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline CAS Name: 5,6-dimethyl-1-(4-nitrophenyl)-2-(4-pentylphenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline IUPAC Name: 5,6-dimethyl-1-(4-nitrophenyl)-2-(4-pentylphenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline Traditional Name: 2-(4-amylphenyl)-5,6-dimethyl-1-(4-nitrophenyl)-1,1a-dihydroazirino[1,2-a]quinoxaline Formula: C28H29N3O2 MolecularWeight: 439.54876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C(=C3)C)C)N4C2C4C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C(=C3)C)C)N4C2C4C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C28H29N3O2/c1-4-5-6-7-20-8-10-21(11-9-20)26-28-27(22-12-14-23(15-13-22)31(32)33)30(28)25-17-19(3)18(2)16-24(25)29-26/h8-17,27-28H,4-7H2,1-3H3