[2-ethynyl-5-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-5-phenyl-cyclohex-2-en-1-yl] methanoate

Systemtic Name: [2-ethynyl-5-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-5-phenyl-cyclohex-2-en-1-yl] methanoate Openeye Name: [5-[(1E,2Z)-1-ethylidenepenta-2,4-dienyl]-2-ethynyl-5-phenyl-cyclohex-2-en-1-yl] formate CAS Name: formic acid [2-ethynyl-5-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-5-phenyl-1-cyclohex-2-enyl] ester IUPAC Name: [2-ethynyl-5-[(2E,4Z)-hepta-2,4,6-trien-3-yl]-5-phenylcyclohex-2-en-1-yl] formate Traditional Name: formic acid [5-[(1E,2Z)-1-ethylidenepenta-2,4-dienyl]-2-ethynyl-5-phenyl-cyclohex-2-en-1-yl] ester Formula: C22H22O2 MolecularWeight: 318.40888

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C=CC=C)C1(CC=C(C(C1)OC=O)C#C)C2=CC=CC=C2

Isomeric SMILES

C/C=C(\C=C/C=C)/C1(CC=C(C(C1)OC=O)C#C)C2=CC=CC=C2

InChI

InChI=1S/C22H22O2/c1-4-7-11-19(6-3)22(20-12-9-8-10-13-20)15-14-18(5-2)21(16-22)24-17-23/h2,4,6-14,17,21H,1,15-16H2,3H3/b11-7-,19-6+