[2-[4-[[(E)-3-phenylbut-2-enoyl]oxymethyl]pyridin-2-yl]pyridin-4-yl]methyl (E)-3-phenylbut-2-enoate

Systemtic Name: [2-[4-[[(E)-3-phenylbut-2-enoyl]oxymethyl]pyridin-2-yl]pyridin-4-yl]methyl (E)-3-phenylbut-2-enoate Openeye Name: [2-[4-[[(E)-3-phenylbut-2-enoyl]oxymethyl]-2-pyridyl]-4-pyridyl]methyl (E)-3-phenylbut-2-enoate CAS Name: (E)-3-phenyl-2-butenoic acid [2-[4-[[(E)-1-oxo-3-phenylbut-2-enoxy]methyl]-2-pyridinyl]-4-pyridinyl]methyl ester IUPAC Name: [2-[4-[[(E)-3-phenylbut-2-enoyl]oxymethyl]pyridin-2-yl]pyridin-4-yl]methyl (E)-3-phenylbut-2-enoate Traditional Name: (E)-3-phenylbut-2-enoic acid [2-[4-[[(E)-3-phenylbut-2-enoyl]oxymethyl]-2-pyridyl]-4-pyridyl]methyl ester Formula: C32H28N2O4 MolecularWeight: 504.57572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)OCC1=CC(=NC=C1)C2=NC=CC(=C2)COC(=O)C=C(C)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C/C(=C\C(=O)OCC1=CC(=NC=C1)C2=NC=CC(=C2)COC(=O)/C=C(/C3=CC=CC=C3)\C)/C4=CC=CC=C4

InChI

InChI=1S/C32H28N2O4/c1-23(27-9-5-3-6-10-27)17-31(35)37-21-25-13-15-33-29(19-25)30-20-26(14-16-34-30)22-38-32(36)18-24(2)28-11-7-4-8-12-28/h3-20H,21-22H2,1-2H3/b23-17+,24-18+