diethyl 2-oxidanylidene-3-[(2S)-pentan-2-yl]butanedioate

Systemtic Name: diethyl 2-oxidanylidene-3-[(2S)-pentan-2-yl]butanedioate Openeye Name: diethyl 2-[(1S)-1-methylbutyl]-3-oxo-butanedioate CAS Name: 2-oxo-3-[(2S)-pentan-2-yl]butanedioic acid diethyl ester IUPAC Name: diethyl 2-oxo-3-[(2S)-pentan-2-yl]butanedioate Traditional Name: 2-keto-3-[(1S)-1-methylbutyl]succinic acid diethyl ester Formula: C13H22O5 MolecularWeight: 258.31078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C(C(=O)C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCC[C@H](C)C(C(=O)C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C13H22O5/c1-5-8-9(4)10(12(15)17-6-2)11(14)13(16)18-7-3/h9-10H,5-8H2,1-4H3/t9-,10?/m0/s1