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

Systemtic Name: ethyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C26H29NO5 MolecularWeight: 435.51216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)C(=CC(=O)NC3=CC=C(C=C3)C(=O)OCC)C

Isomeric SMILES

CCOC1=C(C=C2C(=C(OC2=C1C)C)C)/C(=C/C(=O)NC3=CC=C(C=C3)C(=O)OCC)/C

InChI

InChI=1S/C26H29NO5/c1-7-30-24-17(5)25-22(16(4)18(6)32-25)14-21(24)15(3)13-23(28)27-20-11-9-19(10-12-20)26(29)31-8-2/h9-14H,7-8H2,1-6H3,(H,27,28)/b15-13+