ethyl 2-(4-butylphenyl)carbonylcyclohexa-1,3-diene-1-carboxylate

Systemtic Name: ethyl 2-(4-butylphenyl)carbonylcyclohexa-1,3-diene-1-carboxylate Openeye Name: ethyl 2-(4-butylbenzoyl)cyclohexa-1,3-diene-1-carboxylate CAS Name: 2-[(4-butylphenyl)-oxomethyl]-1-cyclohexa-1,3-dienecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-butylbenzoyl)cyclohexa-1,3-diene-1-carboxylate Traditional Name: 2-(4-butylbenzoyl)cyclohexa-1,3-diene-1-carboxylic acid ethyl ester Formula: C20H24O3 MolecularWeight: 312.40276

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)C2=C(CCC=C2)C(=O)OCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)C2=C(CCC=C2)C(=O)OCC

InChI

InChI=1S/C20H24O3/c1-3-5-8-15-11-13-16(14-12-15)19(21)17-9-6-7-10-18(17)20(22)23-4-2/h6,9,11-14H,3-5,7-8,10H2,1-2H3