O1-methyl O3-(phenylmethyl) 2-cyclohexylpropanedioate

Systemtic Name: O1-methyl O3-(phenylmethyl) 2-cyclohexylpropanedioate Openeye Name: O1-benzyl O3-methyl 2-cyclohexylpropanedioate CAS Name: 2-cyclohexylpropanedioic acid O1-methyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-methyl 2-cyclohexylpropanedioate Traditional Name: 2-cyclohexylmalonic acid O1-benzyl ester O3-methyl ester Formula: C17H22O4 MolecularWeight: 290.35418

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCCCC1)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

COC(=O)C(C1CCCCC1)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H22O4/c1-20-16(18)15(14-10-6-3-7-11-14)17(19)21-12-13-8-4-2-5-9-13/h2,4-5,8-9,14-15H,3,6-7,10-12H2,1H3