2-[4-[2-[4-(2-cyano-4-nitro-phenoxy)phenyl]propan-2-yl]phenoxy]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[4-[2-[4-(2-cyano-4-nitro-phenoxy)phenyl]propan-2-yl]phenoxy]-5-nitro-benzenecarbonitrile Openeye Name: 2-[4-[1-[4-(2-cyano-4-nitro-phenoxy)phenyl]-1-methyl-ethyl]phenoxy]-5-nitro-benzonitrile CAS Name: 2-[4-[2-[4-(2-cyano-4-nitrophenoxy)phenyl]propan-2-yl]phenoxy]-5-nitrobenzonitrile IUPAC Name: 2-[4-[2-[4-(2-cyano-4-nitrophenoxy)phenyl]propan-2-yl]phenoxy]-5-nitrobenzonitrile Traditional Name: 2-[4-[1-[4-(2-cyano-4-nitro-phenoxy)phenyl]-1-methyl-ethyl]phenoxy]-5-nitro-benzonitrile Formula: C29H20N4O6 MolecularWeight: 520.4923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3=CC=C(C=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])C#N

Isomeric SMILES

CC(C)(C1=CC=C(C=C1)OC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3=CC=C(C=C3)OC4=C(C=C(C=C4)[N+](=O)[O-])C#N

InChI

InChI=1S/C29H20N4O6/c1-29(2,21-3-9-25(10-4-21)38-27-13-7-23(32(34)35)15-19(27)17-30)22-5-11-26(12-6-22)39-28-14-8-24(33(36)37)16-20(28)18-31/h3-16H,1-2H3