(E)-3-[3-(3,5-ditert-butyl-2-propoxy-phenyl)-4-methoxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-(3,5-ditert-butyl-2-propoxy-phenyl)-4-methoxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-(3,5-ditert-butyl-2-propoxy-phenyl)-4-methoxy-phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-(3,5-ditert-butyl-2-propoxyphenyl)-4-methoxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-(3,5-ditert-butyl-2-propoxyphenyl)-4-methoxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-(3,5-ditert-butyl-2-propoxy-phenyl)-4-methoxy-phenyl]acrylic acid Formula: C27H36O4 MolecularWeight: 424.57234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1C2=C(C=CC(=C2)C=CC(=O)O)OC)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCOC1=C(C=C(C=C1C2=C(C=CC(=C2)/C=C/C(=O)O)OC)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C27H36O4/c1-9-14-31-25-21(16-19(26(2,3)4)17-22(25)27(5,6)7)20-15-18(11-13-24(28)29)10-12-23(20)30-8/h10-13,15-17H,9,14H2,1-8H3,(H,28,29)/b13-11+