(1E,4E)-1,5-bis[3-methoxy-4-(2-oxidanylidene-2-pyridin-3-yl-ethoxy)phenyl]penta-1,4-dien-3-one

Systemtic Name: (1E,4E)-1,5-bis[3-methoxy-4-(2-oxidanylidene-2-pyridin-3-yl-ethoxy)phenyl]penta-1,4-dien-3-one Openeye Name: (1E,4E)-1,5-bis[3-methoxy-4-[2-oxo-2-(3-pyridyl)ethoxy]phenyl]penta-1,4-dien-3-one CAS Name: (1E,4E)-1,5-bis[3-methoxy-4-[2-oxo-2-(3-pyridinyl)ethoxy]phenyl]-3-penta-1,4-dienone IUPAC Name: (1E,4E)-1,5-bis[3-methoxy-4-(2-oxo-2-pyridin-3-ylethoxy)phenyl]penta-1,4-dien-3-one Traditional Name: (1E,4E)-1,5-bis[4-[2-keto-2-(3-pyridyl)ethoxy]-3-methoxy-phenyl]penta-1,4-dien-3-one Formula: C33H28N2O7 MolecularWeight: 564.58462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C=CC2=CC(=C(C=C2)OCC(=O)C3=CN=CC=C3)OC)OCC(=O)C4=CN=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)/C=C/C2=CC(=C(C=C2)OCC(=O)C3=CN=CC=C3)OC)OCC(=O)C4=CN=CC=C4

InChI

InChI=1S/C33H28N2O7/c1-39-32-17-23(9-13-30(32)41-21-28(37)25-5-3-15-34-19-25)7-11-27(36)12-8-24-10-14-31(33(18-24)40-2)42-22-29(38)26-6-4-16-35-20-26/h3-20H,21-22H2,1-2H3/b11-7+,12-8+