(E)-3-(3-methoxy-4-sulfo-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(3-methoxy-4-sulfo-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(3-methoxy-4-sulfo-phenyl)prop-2-enoic acid CAS Name: (E)-3-(3-methoxy-4-sulfophenyl)-2-propenoic acid IUPAC Name: (E)-3-(3-methoxy-4-sulfophenyl)prop-2-enoic acid Traditional Name: (E)-3-(3-methoxy-4-sulfo-phenyl)acrylic acid Formula: C10H10O6S MolecularWeight: 258.2478

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)O)S(=O)(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)O)S(=O)(=O)O

InChI

InChI=1S/C10H10O6S/c1-16-8-6-7(3-5-10(11)12)2-4-9(8)17(13,14)15/h2-6H,1H3,(H,11,12)(H,13,14,15)/b5-3+