3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitro-quinoxalin-2-yl]phenyl]-5-nitro-quinoxaline

Systemtic Name: 3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitro-quinoxalin-2-yl]phenyl]-5-nitro-quinoxaline Openeye Name: 3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitro-quinoxalin-2-yl]phenyl]-5-nitro-quinoxaline CAS Name: 3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitro-2-quinoxalinyl]phenyl]-5-nitroquinoxaline IUPAC Name: 3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitroquinoxalin-2-yl]phenyl]-5-nitroquinoxaline Traditional Name: 3-(4-tert-butylphenyl)-2-[4-[3-(4-tert-butylphenyl)-5-nitro-quinoxalin-2-yl]phenyl]-5-nitro-quinoxaline Formula: C42H36N6O4 MolecularWeight: 688.77304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3[N+](=O)[O-])N=C2C4=CC=C(C=C4)C5=NC6=C(C(=CC=C6)[N+](=O)[O-])N=C5C7=CC=C(C=C7)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NC3=C(C=CC=C3[N+](=O)[O-])N=C2C4=CC=C(C=C4)C5=NC6=C(C(=CC=C6)[N+](=O)[O-])N=C5C7=CC=C(C=C7)C(C)(C)C

InChI

InChI=1S/C42H36N6O4/c1-41(2,3)29-21-17-27(18-22-29)37-35(43-31-9-7-11-33(47(49)50)39(31)45-37)25-13-15-26(16-14-25)36-38(28-19-23-30(24-20-28)42(4,5)6)46-40-32(44-36)10-8-12-34(40)48(51)52/h7-24H,1-6H3