ethyl 4-[[(E)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(E)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(E)-3-(6-ethoxy-3-phenyl-5-benzofuranyl)-1-oxobut-2-enyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(6-ethoxy-3-phenyl-1-benzofuran-5-yl)but-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(E)-3-(6-ethoxy-3-phenyl-benzofuran-5-yl)but-2-enoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C28H32N2O5 MolecularWeight: 476.56408

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)C(=CC(=O)NC4CCN(CC4)C(=O)OCC)C

Isomeric SMILES

CCOC1=C(C=C2C(=C1)OC=C2C3=CC=CC=C3)/C(=C/C(=O)NC4CCN(CC4)C(=O)OCC)/C

InChI

InChI=1S/C28H32N2O5/c1-4-33-25-17-26-23(24(18-35-26)20-9-7-6-8-10-20)16-22(25)19(3)15-27(31)29-21-11-13-30(14-12-21)28(32)34-5-2/h6-10,15-18,21H,4-5,11-14H2,1-3H3,(H,29,31)/b19-15+