ethyl 4-[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enoyl]piperazine-1-carboxylate CAS Name: 4-[(E)-3-(6-methoxy-3,7-dimethyl-5-benzofuranyl)-1-oxobut-2-enyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(E)-3-(6-methoxy-3,7-dimethyl-1-benzofuran-5-yl)but-2-enoyl]piperazine-1-carboxylate Traditional Name: 4-[(E)-3-(6-methoxy-3,7-dimethyl-benzofuran-5-yl)but-2-enoyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H28N2O5 MolecularWeight: 400.46812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C=C(C)C2=C(C(=C3C(=C2)C(=CO3)C)C)OC

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)/C=C(\C)/C2=C(C(=C3C(=C2)C(=CO3)C)C)OC

InChI

InChI=1S/C22H28N2O5/c1-6-28-22(26)24-9-7-23(8-10-24)19(25)11-14(2)17-12-18-15(3)13-29-21(18)16(4)20(17)27-5/h11-13H,6-10H2,1-5H3/b14-11+