(2S)-2-(4-pentoxyphenyl)butanedioate

Systemtic Name: (2S)-2-(4-pentoxyphenyl)butanedioate Openeye Name: (2S)-2-(4-pentoxyphenyl)butanedioate CAS Name: (2S)-2-(4-pentoxyphenyl)butanedioate IUPAC Name: (2S)-2-(4-pentoxyphenyl)butanedioate Traditional Name: (2S)-2-(4-amoxyphenyl)succinate Formula: C15H18O5-2 MolecularWeight: 278.30042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)[C@H](CC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H20O5/c1-2-3-4-9-20-12-7-5-11(6-8-12)13(15(18)19)10-14(16)17/h5-8,13H,2-4,9-10H2,1H3,(H,16,17)(H,18,19)/p-2/t13-/m0/s1