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

Systemtic Name: (E)-3-[4-(nonadecylamino)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(nonadecylamino)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(nonadecylamino)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(nonadecylamino)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(nonadecylamino)phenyl]acrylic acid Formula: C28H47NO2 MolecularWeight: 429.67828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C(=O)O

InChI

InChI=1S/C28H47NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-25-29-27-22-19-26(20-23-27)21-24-28(30)31/h19-24,29H,2-18,25H2,1H3,(H,30,31)/b24-21+