2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene

Systemtic Name: 2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene Openeye Name: 2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene CAS Name: 2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene IUPAC Name: 2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene Traditional Name: 2,4-dinitro-1-(4-phenylbut-3-ynoxy)benzene Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C#CCCOC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C#CCCOC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c19-17(20)14-9-10-16(15(12-14)18(21)22)23-11-5-4-8-13-6-2-1-3-7-13/h1-3,6-7,9-10,12H,5,11H2