methyl 3-[[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]thiophene-2-carboxylate Openeye Name: methyl 3-[[(E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enoyl]amino]thiophene-2-carboxylate CAS Name: 3-[[(E)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-1-oxobut-2-enyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[(E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enoyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C21H21NO5S MolecularWeight: 399.46014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC2=C(C(=C(C=C12)C(=CC(=O)NC3=C(SC=C3)C(=O)OC)C)OC)C

Isomeric SMILES

CC1=COC2=C(C(=C(C=C12)/C(=C/C(=O)NC3=C(SC=C3)C(=O)OC)/C)OC)C

InChI

InChI=1S/C21H21NO5S/c1-11(8-17(23)22-16-6-7-28-20(16)21(24)26-5)14-9-15-12(2)10-27-19(15)13(3)18(14)25-4/h6-10H,1-5H3,(H,22,23)/b11-8+