ethyl 4-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[(E)-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]amino]piperidine-1-carboxylate CAS Name: 4-[[(E)-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[(E)-3-(2-ethylbenzofuran-3-yl)acryloyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)NC3CCN(CC3)C(=O)OCC

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)NC3CCN(CC3)C(=O)OCC

InChI

InChI=1S/C21H26N2O4/c1-3-18-17(16-7-5-6-8-19(16)27-18)9-10-20(24)22-15-11-13-23(14-12-15)21(25)26-4-2/h5-10,15H,3-4,11-14H2,1-2H3,(H,22,24)/b10-9+