pyridin-2-ylmethyl (E)-3-[4-(pentadecylamino)phenyl]prop-2-enoate

Systemtic Name: pyridin-2-ylmethyl (E)-3-[4-(pentadecylamino)phenyl]prop-2-enoate Openeye Name: 2-pyridylmethyl (E)-3-[4-(pentadecylamino)phenyl]prop-2-enoate CAS Name: (E)-3-[4-(pentadecylamino)phenyl]-2-propenoic acid 2-pyridinylmethyl ester IUPAC Name: pyridin-2-ylmethyl (E)-3-[4-(pentadecylamino)phenyl]prop-2-enoate Traditional Name: (E)-3-[4-(pentadecylamino)phenyl]acrylic acid 2-pyridylmethyl ester Formula: C30H44N2O2 MolecularWeight: 464.68256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)C=CC(=O)OCC2=CC=CC=N2

Isomeric SMILES

CCCCCCCCCCCCCCCNC1=CC=C(C=C1)/C=C/C(=O)OCC2=CC=CC=N2

InChI

InChI=1S/C30H44N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-15-24-31-28-21-18-27(19-22-28)20-23-30(33)34-26-29-17-14-16-25-32-29/h14,16-23,25,31H,2-13,15,24,26H2,1H3/b23-20+