1-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl ethanoate

Systemtic Name: 1-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxypropan-2-yl ethanoate Openeye Name: [1-methyl-2-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-ethyl] acetate CAS Name: acetic acid 1-[(1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl)oxy]propan-2-yl ester IUPAC Name: 1-(1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl)oxypropan-2-yl acetate Traditional Name: acetic acid [2-(1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl)oxy-1-methyl-ethyl] ester Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)C

Isomeric SMILES

CCCCCC1(C=CC(C=C1)C2=CC=CC=C2)OCC(C)OC(=O)C

InChI

InChI=1S/C22H30O3/c1-4-5-9-14-22(24-17-18(2)25-19(3)23)15-12-21(13-16-22)20-10-7-6-8-11-20/h6-8,10-13,15-16,18,21H,4-5,9,14,17H2,1-3H3