sodium (E)-3-[4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-phenyl]prop-2-enoate

Systemtic Name: sodium (E)-3-[4-methoxy-3-(3-methylbut-2-enyl)-2-oxidanyl-phenyl]prop-2-enoate Openeye Name: sodium (E)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]prop-2-enoate CAS Name: sodium (E)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]-2-propenoate IUPAC Name: sodium (E)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]prop-2-enoate Traditional Name: sodium (E)-3-[2-hydroxy-4-methoxy-3-(3-methylbut-2-enyl)phenyl]acrylate Formula: C15H17NaO4 MolecularWeight: 284.28285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CCC1=C(C=CC(=C1O)C=CC(=O)[O-])OC)C.[Na+]

Isomeric SMILES

CC(=CCC1=C(C=CC(=C1O)/C=C/C(=O)[O-])OC)C.[Na+]

InChI

InChI=1S/C15H18O4.Na/c1-10(2)4-7-12-13(19-3)8-5-11(15(12)18)6-9-14(16)17;/h4-6,8-9,18H,7H2,1-3H3,(H,16,17);/q;+1/p-1/b9-6+;