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

Systemtic Name: methyl 4-[[(E)-3-(6-ethoxy-2,3,7-trimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]benzoate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C25H27NO5 MolecularWeight: 421.48558

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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)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C25H27NO5/c1-7-30-23-16(4)24-21(15(3)17(5)31-24)13-20(23)14(2)12-22(27)26-19-10-8-18(9-11-19)25(28)29-6/h8-13H,7H2,1-6H3,(H,26,27)/b14-12+