tert-butyl 2-methyl-3-(2-oxidanylidene-1-prop-2-enyl-cycloheptyl)propanoate

Systemtic Name: tert-butyl 2-methyl-3-(2-oxidanylidene-1-prop-2-enyl-cycloheptyl)propanoate Openeye Name: tert-butyl 3-(1-allyl-2-oxo-cycloheptyl)-2-methyl-propanoate CAS Name: 2-methyl-3-(2-oxo-1-prop-2-enylcycloheptyl)propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-methyl-3-(2-oxo-1-prop-2-enylcycloheptyl)propanoate Traditional Name: 3-(1-allyl-2-keto-cycloheptyl)-2-methyl-propionic acid tert-butyl ester Formula: C18H30O3 MolecularWeight: 294.429

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1(CCCCCC1=O)CC=C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(CC1(CCCCCC1=O)CC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H30O3/c1-6-11-18(12-9-7-8-10-15(18)19)13-14(2)16(20)21-17(3,4)5/h6,14H,1,7-13H2,2-5H3