O1-ethyl O4-(phenylmethyl) (2R)-2-oxidanyl-2-[(E)-2-phenylethenyl]butanedioate

Systemtic Name: O1-ethyl O4-(phenylmethyl) (2R)-2-oxidanyl-2-[(E)-2-phenylethenyl]butanedioate Openeye Name: O4-benzyl O1-ethyl (2R)-2-hydroxy-2-[(E)-styryl]butanedioate CAS Name: (2R)-2-hydroxy-2-[(E)-2-phenylethenyl]butanedioic acid O1-ethyl ester O4-(phenylmethyl) ester IUPAC Name: 4-O-benzyl 1-O-ethyl (2R)-2-hydroxy-2-[(E)-2-phenylethenyl]butanedioate Traditional Name: (2R)-2-hydroxy-2-[(E)-styryl]succinic acid O4-benzyl ester O1-ethyl ester Formula: C21H22O5 MolecularWeight: 354.39638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)OCC1=CC=CC=C1)(C=CC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)[C@@](CC(=O)OCC1=CC=CC=C1)(/C=C/C2=CC=CC=C2)O

InChI

InChI=1S/C21H22O5/c1-2-25-20(23)21(24,14-13-17-9-5-3-6-10-17)15-19(22)26-16-18-11-7-4-8-12-18/h3-14,24H,2,15-16H2,1H3/b14-13+/t21-/m0/s1