1-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl butanoate

Systemtic Name: 1-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl butanoate Openeye Name: 1-(1-pentyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl butanoate CAS Name: butanoic acid 1-(1-pentyl-4-phenyl-1-cyclohexa-2,5-dienyl)ethyl ester IUPAC Name: 1-(1-pentyl-4-phenylcyclohexa-2,5-dien-1-yl)ethyl butanoate Traditional Name: butyric acid 1-(1-amyl-4-phenyl-cyclohexa-2,5-dien-1-yl)ethyl ester Formula: C23H32O2 MolecularWeight: 340.49898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H32O2/c1-4-6-10-16-23(19(3)25-22(24)11-5-2)17-14-21(15-18-23)20-12-8-7-9-13-20/h7-9,12-15,17-19,21H,4-6,10-11,16H2,1-3H3