5-ethyl-5-ethynyl-2-phenyl-cyclohexa-1,3-diene

Systemtic Name: 5-ethyl-5-ethynyl-2-phenyl-cyclohexa-1,3-diene Openeye Name: 5-ethyl-5-ethynyl-2-phenyl-cyclohexa-1,3-diene CAS Name: 5-ethyl-5-ethynyl-2-phenylcyclohexa-1,3-diene IUPAC Name: 5-ethyl-5-ethynyl-2-phenylcyclohexa-1,3-diene Traditional Name: 5-ethyl-5-ethynyl-2-phenyl-cyclohexa-1,3-diene Formula: C16H16 MolecularWeight: 208.29824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC=C(C=C1)C2=CC=CC=C2)C#C

Isomeric SMILES

CCC1(CC=C(C=C1)C2=CC=CC=C2)C#C

InChI

InChI=1S/C16H16/c1-3-16(4-2)12-10-15(11-13-16)14-8-6-5-7-9-14/h1,5-12H,4,13H2,2H3