methyl 3-methyl-6-oxidanylidene-3-(2-phenylmethoxyethyl)cyclohexa-1,4-diene-1-carboxylate

Systemtic Name: methyl 3-methyl-6-oxidanylidene-3-(2-phenylmethoxyethyl)cyclohexa-1,4-diene-1-carboxylate Openeye Name: methyl 3-(2-benzyloxyethyl)-3-methyl-6-oxo-cyclohexa-1,4-diene-1-carboxylate CAS Name: 3-methyl-6-oxo-3-(2-phenylmethoxyethyl)-1-cyclohexa-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-6-oxo-3-(2-phenylmethoxyethyl)cyclohexa-1,4-diene-1-carboxylate Traditional Name: 3-(2-benzoxyethyl)-6-keto-3-methyl-cyclohexa-1,4-diene-1-carboxylic acid methyl ester Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC(=O)C(=C1)C(=O)OC)CCOCC2=CC=CC=C2

Isomeric SMILES

CC1(C=CC(=O)C(=C1)C(=O)OC)CCOCC2=CC=CC=C2

InChI

InChI=1S/C18H20O4/c1-18(9-8-16(19)15(12-18)17(20)21-2)10-11-22-13-14-6-4-3-5-7-14/h3-9,12H,10-11,13H2,1-2H3