nonan-2-yl 1-oxidanyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate

Systemtic Name: nonan-2-yl 1-oxidanyl-4-phenyl-cyclohexa-2,5-diene-1-carboxylate Openeye Name: 1-methyloctyl 1-hydroxy-4-phenyl-cyclohexa-2,5-diene-1-carboxylate CAS Name: 1-hydroxy-4-phenyl-1-cyclohexa-2,5-dienecarboxylic acid nonan-2-yl ester IUPAC Name: nonan-2-yl 1-hydroxy-4-phenylcyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-hydroxy-4-phenyl-cyclohexa-2,5-diene-1-carboxylic acid 1-methyloctyl ester Formula: C22H30O3 MolecularWeight: 342.4718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30O3/c1-3-4-5-6-8-11-18(2)25-21(23)22(24)16-14-20(15-17-22)19-12-9-7-10-13-19/h7,9-10,12-18,20,24H,3-6,8,11H2,1-2H3