2,6-bis(4-nitrophenyl)-2,6-diphenyl-heptanedinitrile

Systemtic Name: 2,6-bis(4-nitrophenyl)-2,6-diphenyl-heptanedinitrile Openeye Name: 2,6-bis(4-nitrophenyl)-2,6-diphenyl-heptanedinitrile CAS Name: 2,6-bis(4-nitrophenyl)-2,6-diphenylheptanedinitrile IUPAC Name: 2,6-bis(4-nitrophenyl)-2,6-diphenylheptanedinitrile Traditional Name: 2,6-bis(4-nitrophenyl)-2,6-diphenyl-pimelonitrile Formula: C31H24N4O4 MolecularWeight: 516.54666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H24N4O4/c32-22-30(24-8-3-1-4-9-24,26-12-16-28(17-13-26)34(36)37)20-7-21-31(23-33,25-10-5-2-6-11-25)27-14-18-29(19-15-27)35(38)39/h1-6,8-19H,7,20-21H2