2-[5-[(E)-2-(4-sulfophenyl)ethenyl]naphthalen-1-yl]ethanoic acid

Systemtic Name: 2-[5-[(E)-2-(4-sulfophenyl)ethenyl]naphthalen-1-yl]ethanoic acid Openeye Name: 2-[5-[(E)-2-(4-sulfophenyl)vinyl]-1-naphthyl]acetic acid CAS Name: 2-[5-[(E)-2-(4-sulfophenyl)ethenyl]-1-naphthalenyl]acetic acid IUPAC Name: 2-[5-[(E)-2-(4-sulfophenyl)ethenyl]naphthalen-1-yl]acetic acid Traditional Name: 2-[5-[(E)-2-(4-sulfophenyl)vinyl]-1-naphthyl]acetic acid Formula: C20H16O5S MolecularWeight: 368.40304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC=C2C=CC3=CC=C(C=C3)S(=O)(=O)O)C(=C1)CC(=O)O

Isomeric SMILES

C1=CC2=C(C=CC=C2/C=C/C3=CC=C(C=C3)S(=O)(=O)O)C(=C1)CC(=O)O

InChI

InChI=1S/C20H16O5S/c21-20(22)13-16-4-2-5-18-15(3-1-6-19(16)18)10-7-14-8-11-17(12-9-14)26(23,24)25/h1-12H,13H2,(H,21,22)(H,23,24,25)/b10-7+