butyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate

Systemtic Name: butyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Openeye Name: butyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-5-benzofuranyl)-1-oxobut-2-enyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-benzofuran-5-yl)but-2-enoyl]amino]benzoic acid butyl ester Formula: C28H33NO5 MolecularWeight: 463.56532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C=C(C)C2=C(C(=C3C(=C2)C(=C(O3)C)C)C)OCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)/C=C(\C)/C2=C(C(=C3C(=C2)C(=C(O3)C)C)C)OCC

InChI

InChI=1S/C28H33NO5/c1-7-9-14-33-28(31)21-10-12-22(13-11-21)29-25(30)15-17(3)23-16-24-18(4)20(6)34-27(24)19(5)26(23)32-8-2/h10-13,15-16H,7-9,14H2,1-6H3,(H,29,30)/b17-15+