(E)-3-[4-[3-(cyclododecylmethyl)-4-oxidanyl-phenyl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[3-(cyclododecylmethyl)-4-oxidanyl-phenyl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[3-(cyclododecylmethyl)-4-hydroxy-phenyl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[3-(cyclododecylmethyl)-4-hydroxyphenyl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[3-(cyclododecylmethyl)-4-hydroxyphenyl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[3-(cyclododecylmethyl)-4-hydroxy-phenyl]phenyl]acrylic acid Formula: C28H36O3 MolecularWeight: 420.58364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(CCCCC1)CC2=C(C=CC(=C2)C3=CC=C(C=C3)C=CC(=O)O)O

Isomeric SMILES

C1CCCCCC(CCCCC1)CC2=C(C=CC(=C2)C3=CC=C(C=C3)/C=C/C(=O)O)O

InChI

InChI=1S/C28H36O3/c29-27-18-17-25(24-15-12-22(13-16-24)14-19-28(30)31)21-26(27)20-23-10-8-6-4-2-1-3-5-7-9-11-23/h12-19,21,23,29H,1-11,20H2,(H,30,31)/b19-14+