1-[2-(4,4-diphenylcyclohexen-1-yl)ethynyl]-4-nitro-benzene

Systemtic Name: 1-[2-(4,4-diphenylcyclohexen-1-yl)ethynyl]-4-nitro-benzene Openeye Name: 1-[2-(4,4-diphenylcyclohexen-1-yl)ethynyl]-4-nitro-benzene CAS Name: 1-[2-(4,4-diphenyl-1-cyclohexenyl)ethynyl]-4-nitrobenzene IUPAC Name: 1-[2-(4,4-diphenylcyclohexen-1-yl)ethynyl]-4-nitrobenzene Traditional Name: 1-[2-(4,4-diphenylcyclohexen-1-yl)ethynyl]-4-nitro-benzene Formula: C26H21NO2 MolecularWeight: 379.45044

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1C#CC2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC(CC=C1C#CC2=CC=C(C=C2)[N+](=O)[O-])(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H21NO2/c28-27(29)25-15-13-21(14-16-25)11-12-22-17-19-26(20-18-22,23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-10,13-17H,18-20H2