methyl (1R,5S)-1-methyl-3-oxidanylidene-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate

Systemtic Name: methyl (1R,5S)-1-methyl-3-oxidanylidene-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate Openeye Name: methyl (1R,5S)-1-methyl-3-oxo-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate CAS Name: (1R,5S)-1-methyl-3-oxo-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylic acid methyl ester IUPAC Name: methyl (1R,5S)-1-methyl-3-oxo-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylate Traditional Name: (1R,5S)-3-keto-1-methyl-5-(3-phenylpropyl)-8-oxabicyclo[3.2.1]octane-2-carboxylic acid methyl ester Formula: C19H24O4 MolecularWeight: 316.39146

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(O1)(CC(=O)C2C(=O)OC)CCCC3=CC=CC=C3

Isomeric SMILES

C[C@]12CC[C@](O1)(CC(=O)C2C(=O)OC)CCCC3=CC=CC=C3

InChI

InChI=1S/C19H24O4/c1-18-11-12-19(23-18,13-15(20)16(18)17(21)22-2)10-6-9-14-7-4-3-5-8-14/h3-5,7-8,16H,6,9-13H2,1-2H3/t16?,18-,19+/m1/s1