methyl (E)-5-(1-oxidanylcyclohexyl)-3-phenyl-pent-2-en-4-ynoate

Systemtic Name: methyl (E)-5-(1-oxidanylcyclohexyl)-3-phenyl-pent-2-en-4-ynoate Openeye Name: methyl (E)-5-(1-hydroxycyclohexyl)-3-phenyl-pent-2-en-4-ynoate CAS Name: (E)-5-(1-hydroxycyclohexyl)-3-phenylpent-2-en-4-ynoic acid methyl ester IUPAC Name: methyl (E)-5-(1-hydroxycyclohexyl)-3-phenylpent-2-en-4-ynoate Traditional Name: (E)-5-(1-hydroxycyclohexyl)-3-phenyl-pent-2-en-4-ynoic acid methyl ester Formula: C18H20O3 MolecularWeight: 284.3496

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(C#CC1(CCCCC1)O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)/C=C(/C#CC1(CCCCC1)O)\C2=CC=CC=C2

InChI

InChI=1S/C18H20O3/c1-21-17(19)14-16(15-8-4-2-5-9-15)10-13-18(20)11-6-3-7-12-18/h2,4-5,8-9,14,20H,3,6-7,11-12H2,1H3/b16-14-