3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylselanyl]benzene-1,2-dicarbonitrile

Systemtic Name: 3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylselanyl]benzene-1,2-dicarbonitrile Openeye Name: 3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylselanyl]phthalonitrile CAS Name: 3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylseleno]benzene-1,2-dicarbonitrile IUPAC Name: 3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylselanyl]benzene-1,2-dicarbonitrile Traditional Name: 3,6-diethyl-4,5-bis[2-(4-nitrophenyl)ethylseleno]phthalonitrile Formula: C28H26N4O4Se2 MolecularWeight: 640.45044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C(=C1C#N)C#N)CC)[Se]CCC2=CC=C(C=C2)[N+](=O)[O-])[Se]CCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=C(C(=C1C#N)C#N)CC)[Se]CCC2=CC=C(C=C2)[N+](=O)[O-])[Se]CCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C28H26N4O4Se2/c1-3-23-25(17-29)26(18-30)24(4-2)28(38-16-14-20-7-11-22(12-8-20)32(35)36)27(23)37-15-13-19-5-9-21(10-6-19)31(33)34/h5-12H,3-4,13-16H2,1-2H3