2,5-bis(2-methylpropyl)-3-[2-(2-nitrophenyl)ethynyl]pyrazine

Systemtic Name: 2,5-bis(2-methylpropyl)-3-[2-(2-nitrophenyl)ethynyl]pyrazine Openeye Name: 2,5-diisobutyl-3-[2-(2-nitrophenyl)ethynyl]pyrazine CAS Name: 2,5-bis(2-methylpropyl)-3-[2-(2-nitrophenyl)ethynyl]pyrazine IUPAC Name: 2,5-bis(2-methylpropyl)-3-[2-(2-nitrophenyl)ethynyl]pyrazine Traditional Name: 2,5-diisobutyl-3-[2-(2-nitrophenyl)ethynyl]pyrazine Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CN=C(C(=N1)C#CC2=CC=CC=C2[N+](=O)[O-])CC(C)C

Isomeric SMILES

CC(C)CC1=CN=C(C(=N1)C#CC2=CC=CC=C2[N+](=O)[O-])CC(C)C

InChI

InChI=1S/C20H23N3O2/c1-14(2)11-17-13-21-19(12-15(3)4)18(22-17)10-9-16-7-5-6-8-20(16)23(24)25/h5-8,13-15H,11-12H2,1-4H3