ethyl 1-[[5-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[[5-(phenylmethyl)-2,3-dihydro-1-benzofuran-2-yl]methyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[(5-benzyl-2,3-dihydrobenzofuran-2-yl)methyl]piperidine-4-carboxylate CAS Name: 1-[[5-(phenylmethyl)-2,3-dihydrobenzofuran-2-yl]methyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(5-benzyl-2,3-dihydro-1-benzofuran-2-yl)methyl]piperidine-4-carboxylate Traditional Name: 1-[(5-benzylcoumaran-2-yl)methyl]isonipecotic acid ethyl ester Formula: C24H29NO3 MolecularWeight: 379.49196

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)CC2CC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)CC2CC3=C(O2)C=CC(=C3)CC4=CC=CC=C4

InChI

InChI=1S/C24H29NO3/c1-2-27-24(26)20-10-12-25(13-11-20)17-22-16-21-15-19(8-9-23(21)28-22)14-18-6-4-3-5-7-18/h3-9,15,20,22H,2,10-14,16-17H2,1H3