ethyl 4-ethoxy-1-methyl-2-oxidanylidene-3-(4-phenylmethoxybutyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl 4-ethoxy-1-methyl-2-oxidanylidene-3-(4-phenylmethoxybutyl)cyclohex-3-ene-1-carboxylate Openeye Name: ethyl 3-(4-benzyloxybutyl)-4-ethoxy-1-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 4-ethoxy-1-methyl-2-oxo-3-(4-phenylmethoxybutyl)-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethoxy-1-methyl-2-oxo-3-(4-phenylmethoxybutyl)cyclohex-3-ene-1-carboxylate Traditional Name: 3-(4-benzoxybutyl)-4-ethoxy-2-keto-1-methyl-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H32O5 MolecularWeight: 388.49718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=O)C(CC1)(C)C(=O)OCC)CCCCOCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=O)C(CC1)(C)C(=O)OCC)CCCCOCC2=CC=CC=C2

InChI

InChI=1S/C23H32O5/c1-4-27-20-14-15-23(3,22(25)28-5-2)21(24)19(20)13-9-10-16-26-17-18-11-7-6-8-12-18/h6-8,11-12H,4-5,9-10,13-17H2,1-3H3