pyridin-3-yl (E)-3-[4-(7-cyclopentylheptylamino)phenyl]prop-2-enoate

Systemtic Name: pyridin-3-yl (E)-3-[4-(7-cyclopentylheptylamino)phenyl]prop-2-enoate Openeye Name: 3-pyridyl (E)-3-[4-(7-cyclopentylheptylamino)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(7-cyclopentylheptylamino)phenyl]-2-propenoic acid 3-pyridinyl ester IUPAC Name: pyridin-3-yl (E)-3-[4-(7-cyclopentylheptylamino)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(7-cyclopentylheptylamino)phenyl]acrylic acid 3-pyridyl ester Formula: C26H34N2O2 MolecularWeight: 406.56036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCCCCCCNC2=CC=C(C=C2)C=CC(=O)OC3=CN=CC=C3

Isomeric SMILES

C1CCC(C1)CCCCCCCNC2=CC=C(C=C2)/C=C/C(=O)OC3=CN=CC=C3

InChI

InChI=1S/C26H34N2O2/c29-26(30-25-12-8-19-27-21-25)18-15-23-13-16-24(17-14-23)28-20-7-3-1-2-4-9-22-10-5-6-11-22/h8,12-19,21-22,28H,1-7,9-11,20H2/b18-15+