sodium 2-[(1R,6R)-6-oxidanylcyclohexa-2,4-dien-1-yl]oxyprop-2-enoate

Systemtic Name: sodium 2-[(1R,6R)-6-oxidanylcyclohexa-2,4-dien-1-yl]oxyprop-2-enoate Openeye Name: sodium 2-[(1R,6R)-6-hydroxycyclohexa-2,4-dien-1-yl]oxyprop-2-enoate CAS Name: sodium 2-[[(1R,6R)-6-hydroxy-1-cyclohexa-2,4-dienyl]oxy]-2-propenoate IUPAC Name: sodium 2-[(1R,6R)-6-hydroxycyclohexa-2,4-dien-1-yl]oxyprop-2-enoate Traditional Name: sodium 2-[(1R,6R)-6-hydroxycyclohexa-2,4-dien-1-yl]oxyacrylate Formula: C9H9NaO4 MolecularWeight: 204.15513

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C(C(=O)[O-])OC1C=CC=CC1O.[Na+]

Isomeric SMILES

C=C(C(=O)[O-])O[C@@H]1C=CC=C[C@H]1O.[Na+]

InChI

InChI=1S/C9H10O4.Na/c1-6(9(11)12)13-8-5-3-2-4-7(8)10;/h2-5,7-8,10H,1H2,(H,11,12);/q;+1/p-1/t7-,8-;/m1./s1