methyl 1-(4-phenylmethoxybut-1-ynyl)cyclohexane-1-carboxylate

Systemtic Name: methyl 1-(4-phenylmethoxybut-1-ynyl)cyclohexane-1-carboxylate Openeye Name: methyl 1-(4-benzyloxybut-1-ynyl)cyclohexanecarboxylate CAS Name: 1-(4-phenylmethoxybut-1-ynyl)-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-phenylmethoxybut-1-ynyl)cyclohexane-1-carboxylate Traditional Name: 1-(4-benzoxybut-1-ynyl)cyclohexanecarboxylic acid methyl ester Formula: C19H24O3 MolecularWeight: 300.39206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)C#CCCOCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C1(CCCCC1)C#CCCOCC2=CC=CC=C2

InChI

InChI=1S/C19H24O3/c1-21-18(20)19(12-6-3-7-13-19)14-8-9-15-22-16-17-10-4-2-5-11-17/h2,4-5,10-11H,3,6-7,9,12-13,15-16H2,1H3