O1-ethyl O3-methyl 2-(3-oxidanylidenebutyl)-2-(phenylmethyl)propanedioate

Systemtic Name: O1-ethyl O3-methyl 2-(3-oxidanylidenebutyl)-2-(phenylmethyl)propanedioate Openeye Name: O1-ethyl O3-methyl 2-benzyl-2-(3-oxobutyl)propanedioate CAS Name: 2-(3-oxobutyl)-2-(phenylmethyl)propanedioic acid O1-ethyl ester O3-methyl ester IUPAC Name: 1-O-ethyl 3-O-methyl 2-benzyl-2-(3-oxobutyl)propanedioate Traditional Name: 2-benzyl-2-(3-ketobutyl)malonic acid O1-ethyl ester O3-methyl ester Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC(=O)C)(CC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCOC(=O)C(CCC(=O)C)(CC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C17H22O5/c1-4-22-16(20)17(15(19)21-3,11-10-13(2)18)12-14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3