2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-(2-methoxy-2-oxidanylidene-ethyl)butanedioic acid

Systemtic Name: 2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-(2-methoxy-2-oxidanylidene-ethyl)butanedioic acid Openeye Name: 2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-(2-methoxy-2-oxo-ethyl)butanedioic acid CAS Name: 2-[(E)-3-(4-hydroxyphenyl)-1-oxoprop-2-enoxy]-3-(2-methoxy-2-oxoethyl)butanedioic acid IUPAC Name: 2-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy-3-(2-methoxy-2-oxoethyl)butanedioic acid Traditional Name: 2-[(E)-3-(4-hydroxyphenyl)acryloyl]oxy-3-(2-keto-2-methoxy-ethyl)succinic acid Formula: C16H16O9 MolecularWeight: 352.29284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C(C(=O)O)OC(=O)C=CC1=CC=C(C=C1)O)C(=O)O

Isomeric SMILES

COC(=O)CC(C(C(=O)O)OC(=O)/C=C/C1=CC=C(C=C1)O)C(=O)O

InChI

InChI=1S/C16H16O9/c1-24-13(19)8-11(15(20)21)14(16(22)23)25-12(18)7-4-9-2-5-10(17)6-3-9/h2-7,11,14,17H,8H2,1H3,(H,20,21)(H,22,23)/b7-4+