[2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(2S)-2-ethylpiperidin-1-yl]-2-oxidanylidene-ethyl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Openeye Name: [2-[(2S)-2-ethyl-1-piperidyl]-2-oxo-ethyl] 5-ethoxy-3-methyl-benzofuran-2-carboxylate CAS Name: 5-ethoxy-3-methyl-2-benzofurancarboxylic acid [2-[(2S)-2-ethyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2S)-2-ethylpiperidin-1-yl]-2-oxoethyl] 5-ethoxy-3-methyl-1-benzofuran-2-carboxylate Traditional Name: 5-ethoxy-3-methyl-coumarilic acid [2-[(2S)-2-ethylpiperidino]-2-keto-ethyl] ester Formula: C21H27NO5 MolecularWeight: 373.44278

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=O)COC(=O)C2=C(C3=C(O2)C=CC(=C3)OCC)C

Isomeric SMILES

CC[C@H]1CCCCN1C(=O)COC(=O)C2=C(C3=C(O2)C=CC(=C3)OCC)C

InChI

InChI=1S/C21H27NO5/c1-4-15-8-6-7-11-22(15)19(23)13-26-21(24)20-14(3)17-12-16(25-5-2)9-10-18(17)27-20/h9-10,12,15H,4-8,11,13H2,1-3H3/t15-/m0/s1