ethyl (E)-3-[3-[(2-butyl-1-benzofuran-3-yl)methoxy]phenyl]but-2-enoate

Systemtic Name: ethyl (E)-3-[3-[(2-butyl-1-benzofuran-3-yl)methoxy]phenyl]but-2-enoate Openeye Name: ethyl (E)-3-[3-[(2-butylbenzofuran-3-yl)methoxy]phenyl]but-2-enoate CAS Name: (E)-3-[3-[(2-butyl-3-benzofuranyl)methoxy]phenyl]-2-butenoic acid ethyl ester IUPAC Name: ethyl (E)-3-[3-[(2-butyl-1-benzofuran-3-yl)methoxy]phenyl]but-2-enoate Traditional Name: (E)-3-[3-[(2-butylbenzofuran-3-yl)methoxy]phenyl]but-2-enoic acid ethyl ester Formula: C25H28O4 MolecularWeight: 392.48742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C2=CC=CC=C2O1)COC3=CC=CC(=C3)C(=CC(=O)OCC)C

Isomeric SMILES

CCCCC1=C(C2=CC=CC=C2O1)COC3=CC=CC(=C3)/C(=C/C(=O)OCC)/C

InChI

InChI=1S/C25H28O4/c1-4-6-13-24-22(21-12-7-8-14-23(21)29-24)17-28-20-11-9-10-19(16-20)18(3)15-25(26)27-5-2/h7-12,14-16H,4-6,13,17H2,1-3H3/b18-15+