(2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate

Systemtic Name: (2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 3-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2,2-dimethyl-cyclopropane-1-carboxylate Openeye Name: (2,6-dimethyl-4-prop-2-ynyl-phenyl)methyl 3-[(E)-3-methoxy-3-oxo-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,2-dimethyl-1-cyclopropanecarboxylic acid (2,6-dimethyl-4-prop-2-ynylphenyl)methyl ester IUPAC Name: (2,6-dimethyl-4-prop-2-ynylphenyl)methyl 3-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate Traditional Name: 3-[(E)-3-keto-3-methoxy-prop-1-enyl]-2,2-dimethyl-cyclopropanecarboxylic acid (2,6-dimethyl-4-propargyl-benzyl) ester Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1COC(=O)C2C(C2(C)C)C=CC(=O)OC)C)CC#C

Isomeric SMILES

CC1=CC(=CC(=C1COC(=O)C2C(C2(C)C)/C=C/C(=O)OC)C)CC#C

InChI

InChI=1S/C22H26O4/c1-7-8-16-11-14(2)17(15(3)12-16)13-26-21(24)20-18(22(20,4)5)9-10-19(23)25-6/h1,9-12,18,20H,8,13H2,2-6H3/b10-9+